SCHEMBL1036360

SCHEMBL1036360

C1=NCCN1Nc1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
TDP1 Q9NUW8 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
IDO1 P14902 1/20 0.34
PTGS2 P35354 1/20 0.34
POLB P06746 4/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
NISCH Q9Y2I1 1/20 0.33
HTR3E A5X5Y0 1/20 0.32
HTR3B O95264 1/20 0.32
ADRB1 P08588 1/20 0.32
HTR3A P46098 1/20 0.32
HTR3D Q70Z44 1/20 0.32

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
SCHEMBL11198442 0.81 TDP1 (0.39) LMNATDP1CYP1A2CYP2C9CYP2C19
SCHEMBL7753131 0.78 MEN1 (0.46) POLBKMT2AHTTALDH1A1HSD17B10
SCHEMBL7099438 0.74 KDM4E (0.48) LMNAPOLBKMT2AHTTHTR3A
SCHEMBL8020018 0.74 ADRA2B (0.41) LMNACYP2C19POLBKMT2AHTT
SCHEMBL6977056 0.74 SIRT6 (0.44) LMNAPOLBKMT2AADRB1ALDH1A1
SCHEMBL15453937 0.73 ARG1 (0.35)
SCHEMBL6072900 0.72 NPC1 (0.43) LMNACYP3A4PTGS2KMT2AALDH1A1
SCHEMBL10631363 0.72 ADRA2A (0.40) LMNACYP2C9CYP2C19CYP2D6KMT2A
Acetic Acid SCHEMBL6967868 0.71 GAA (0.43) LMNAPOLBKMT2AHTTALDH1A1
SCHEMBL8304928 0.71 ADRA2A (0.48) CYP3A4IDO1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112472715-B Sodium bicarbonate enteric capsule and preparation method thereof 华熙生物科技股份有限公司 2023-06-23 CN claimed
CN-112472715-A Sodium bicarbonate enteric-coated capsule and preparation method thereof 华熙生物科技股份有限公司 2021-03-12 CN claimed
EP-2276472-B1 COMPOSITIONS COMPRISING WEAKLY BASIC DRUGS AND CONTROLLED-RELEASE DOSAGE FORMS ADARE PHARMACEUTICALS INC (US) 2018-11-21 EP claimed
CN-104874021-A Method for preparing forging bone for surgical implantation BEIJING AOSITESAI MEDICAL TECHNOLOGY CO LTD 2015-09-02 CN claimed
CN-102006862-A Compositions and controlled release dosage forms comprising weakly basic drugs EURAND INC 2011-04-06 CN claimed
EP-2276472-A1 COMPOSITIONS COMPRISING WEAKLY BASIC DRUGS AND CONTROLLED-RELEASE DOSAGE FORMS Eurand, Inc. (US) 2011-01-26 EP claimed
US-20100239563-A1 PHARMACEUTICAL COMPOSITION FOR THE PROPHYLAXIS AND/OR TREATMENT OF VIRAL DISEASES LUDWIG STEPHAN 2010-09-23 US claimed
WO-2009129282-A1 COMPOSITIONS COMPRISING WEAKLY BASIC DRUGS AND CONTROLLED-RELEASE DOSAGE FORMS EURAND INC (US) 2009-10-22 WO claimed
US-20090258066-A1 COMPOSITIONS COMPRISING WEAKLY BASIC DRUGS AND CONTROLLED-RELEASE DOSAGE FORMS ADARE PHARMACEUTICALS USA, INC. 2009-10-15 US claimed
EP-0821585-B1 USE OF ALPHA 1L-AGONISTS IN THE TREATMENT OF URINARY INCONTINENCE BOEHRINGER INGELHEIM PHARMA (DE) 2007-01-10 EP claimed
EP-1707193-A2 Pharmaceutical composition for the prophylaxis and/or treatment of viral diseases MedInnova Gesellschaft für medizinische Innovationen aus akademischer Forschung mbH (DE) 2006-10-04 EP claimed
EP-1617858-A2 USE OF ACTIVE INGREDIENTS FOR PREVENTING OR TREATING VIRAL ILLNESSES, AND TEST SYSTEM FOR DISCOVERING SUCH ACTIVE INGREDIENTS InAmed GmbH Institut für Aerosol Medizin (DE) 2006-01-25 EP claimed
US-20050129694-A1 Pharmaceutical composition for the prophylaxis and/or treatment of virus diseases LUDWIG STEPHAN (DE) 2005-06-16 US claimed
WO-2004085682-A2 CASPASE INHIBITORS, ESPECIALLY CASPASE 3 INHIBITORS, FOR THE TREATMENT OF INFLUENZA MedInnova Gesellschaft für medizinische Innovationen aus akademischer Forschung mbH (DE) 2004-10-07 WO claimed
EP-1450778-A2 PHARMACEUTICAL COMPOSITION FOR THE PROPHYLAXIS AND/OR TREATMENT OF VIRUS DISEASES MedInnova Gesellschaft für medizinische Innovationen aus akademischer Forschung mbH (DE) 2004-09-01 EP claimed
US-20030114425-A1 Compounds and methods for treating urinary incontinence BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-06-19 US claimed
WO-2003015689-A2 PHARMACEUTICAL COMPOSITION FOR THE PROPHYLAXIS AND/OR TREATMENT OF VIRUS DISEASES MedInnova Gesellschaft für medizinische Innovationen aus akademischer Forschung mbH (DE) 2003-02-27 WO claimed
WO-2002089779-A2 COMBINED PREPARATION FOR THE PROPHYLAXIS AND/OR THERAPY OF NERVE CELL AND/OR GLIA CELL DAMAGE USING A NOVEL METHOD OF TREATMENT MedInnova Gesellschaft für medizinische Innovationen aus akademischer Forschung mbH (DE) 2002-11-14 WO claimed
US-20020040150-A1 SKIN TREATMENT COMPOSITONS CONTAINING A CATIONIC POLYMER AND A MICROPARTICLE OR NANOPARTICLE VECTOR ESSER FRANZ (DE) 2002-04-04 US claimed
CN-1180311-A Use of 'alpha' 1L agonists in treatment of incontinence BOEHRINGER INGELHEIM KG (DE) 1998-04-29 CN claimed

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

For each of this compound's patents that has machine-readable text (2 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-20030114425-A1 Compounds and methods for treating urinary incontinence PDE3A, PDE3B, PDE2A LMNA 2576/4885TDP1 2969/4885CYP1A2 2323/4885
US-20020040150-A1 SKIN TREATMENT COMPOSITONS CONTAINING A CATIONIC POLYMER AND A MICROPARTICLE OR NANOPARTICLE VECTOR COL1A1, TPSAB1, TACR1 LMNA 818/4885TDP1 963/4885CYP1A2 1668/4885

“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.