SCHEMBL3443299

SCHEMBL3443299

CCCOc1ccc(C(=O)O)cc1N

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61
MAOA P21397 1/20 0.61
CYP2C19 P33261 1/20 0.61
SCN1A P35498 1/20 0.61
KCNH2 Q12809 1/20 0.61
SCN2A Q99250 1/20 0.61
SIGMAR1 Q99720 1/20 0.61
SCN3A Q9NY46 1/20 0.61
HRH3 Q9Y5N1 1/20 0.61
USP2 O75604 2/20 0.59
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
HSD17B10 Q99714 1/20 0.59
KMT2A Q03164 2/20 0.58
ALDH1A1 P00352 2/20 0.58
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL11788088 0.98 USP2 (0.61) CYP1A2CYP3A4CYP2D6MAOACYP2C19
SCHEMBL28318456 0.92 ALDH1A1 (0.58) USP2NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL8170141 0.91 ALDH1A1 (0.64) USP2NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL9761401 0.91 ALDH1A1 (0.64) USP2NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL17395848 0.87 CREBBP (0.77) CYP1A2CYP3A4CYP2D6MAOACYP2C19
SCHEMBL3826579 0.87 NPC1 (0.78) USP2NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL566516 0.85 POLB (0.66) RAB9AHSD17B10KMT2AALDH1A1KDM4E
SCHEMBL31529057 0.84 CYP1A2 (0.66) CYP1A2CYP3A4CYP2D6MAOACYP2C19
SCHEMBL31529054 0.84 CYP1A2 (0.66) CYP1A2CYP3A4CYP2D6MAOACYP2C19
SCHEMBL12492247 0.82 THRA (0.56) KMT2AALDH1A1POLBCREBBPHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114008143-A Azo compound, polarizing film containing the same, and polarizing plate 日本化药株式会社 2022-02-01 CN disclosed
US-7816374-B2 Administering to respiratory system an effective amount of a topical anesthetic, such as lidocaine, or a pharmaceutically acceptable salt thereof; chronic obstructive pulmonary disease MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2010-10-19 US disclosed
US-20090286876-A1 NEUROPROTECTIVE BENZOATE AND BENZAMIDE COMPOUNDS SAMARITAN PHARMACEUTICALS, INC. 2009-11-19 US disclosed
US-20090054485-A1 Method of treating neutrophil-related diseases with topical anesthetics GLEICH GERALD J 2009-02-26 US disclosed
EP-1725098-A2 BENZAMIDE AND BENZOATE ANTI-HIV COMPOUNDS Samaritan Pharmaceuticals, Inc. (US) 2006-11-29 EP disclosed
US-20060167108-A1 Neuroprotective benzoate and benzamide compounds GEORGETOWN UNIVERSITY 2006-07-27 US disclosed
US-20060100276-A1 Method of treating neutrophil-related diseases with topical anesthetics MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2006-05-11 US disclosed
EP-1628649-A2 NEUROPROTECTIVE BENZOATE AND BENZAMIDE COMPOUNDS Samaritan Pharmaceuticals (US) 2006-03-01 EP disclosed
WO-2005089453-A2 BENZAMIDE AND BENZOATE ANTI-HIV COMPOUNDS SAMARITAN PHARMACEUTICALS, INC. (US) 2005-09-29 WO disclosed
US-6861449-B2 Method of treating neutrophil-related diseases with topical anesthetics MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2005-03-01 US disclosed
WO-2002000218-A2 METHODS OF TREATING NEUTROPHIL-RELATED DISEASES WITH TOPICAL ANESTHETICS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2002-01-03 WO disclosed
EP-0682514-B1 USE OF TOPICAL ANESTHETICS FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF BRONCHIAL ASTHMA MAYO FOUNDATION FOR MEDICAL (US) 2001-09-12 EP disclosed
WO-2001028550-A1 TOPICAL ANESTHETICS USEFUL FOR TREATING CANCER, AUTOIMMUNE DISEASES AND ISCHEMIA MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2001-04-26 WO disclosed
EP-0979085-A1 TREATMENT OF EOSINOPHIL-ASSOCIATED PATHOLOGIES, SUCH AS BRONCHIAL ASTHMA, WITH SYNERGISTIC COMBINATIONS OF GLUCOCORTICOIDS AND A LOCAL ANESTHETICS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2000-02-16 EP disclosed
US-5837713-A Treatment of eosinophil-associated pathologies by administration of topical anesthetics and glucocorticoids MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 1998-11-17 US disclosed
WO-1998037896-A1 TREATMENT OF EOSINOPHIL-ASSOCIATED PATHOLOGIES, SUCH AS BRONCHIAL ASTHMA, WITH SYNERGISTIC COMBINATIONS OF GLUCOCORTICOIDS AND A LOCAL ANESTHETICS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 1998-09-03 WO disclosed
US-5631267-A BRONCHIAL ASTHMA, NASAL AND SINUS INFLAMMATION, RHINITIS, CONJUNCTIVITIS MAYO FOUNDATION FOR MEDICAL EDUCATION & RESEARCH (US) 1997-05-20 US disclosed
US-5510339-A REDUCING STEROID THERAPY DEPENDENCE BY COUNTERACT THE SYMPTOMS OF ASTHMA MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 1996-04-23 US disclosed
WO-1994017790-A9 USE OF TOPICAL ANESTHETICS FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF BRONCHIAL ASTHMA 1994-09-29 WO disclosed
US-3952058-A Sweetener DYNAPOL (US) 1976-04-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060100276-A1 Method of treating neutrophil-related diseases with topical anesthetics MMP8, ELANE, MPO CYP1A2 2569/4885CYP3A4 3684/4885CYP2D6 3844/4885
US-20090286876-A1 NEUROPROTECTIVE BENZOATE AND BENZAMIDE COMPOUNDS ABAT, GABRB2, GABRB1 CYP1A2 3131/4885CYP3A4 3285/4885CYP2D6 3884/4885
US-20060167108-A1 Neuroprotective benzoate and benzamide compounds ABAT, GABRB2, GABRB1 CYP1A2 3131/4885CYP3A4 3285/4885CYP2D6 3884/4885
US-20090054485-A1 Method of treating neutrophil-related diseases with topical anesthetics MMP8, ELANE, MPO CYP1A2 2569/4885CYP3A4 3684/4885CYP2D6 3844/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.