SCHEMBL6447477

SCHEMBL6447477

[O]C(=O)Cc1ccccn1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.56
NPC1 O15118 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
PTPRA P18433 1/20 0.52
POLB P06746 2/20 0.50
IDO1 P14902 1/20 0.49
CYP1A2 P05177 2/20 0.49
ALDH1A1 P00352 1/20 0.49
TSHR P16473 1/20 0.49
CYP2C19 P33261 1/20 0.47
FDPS P14324 1/20 0.47
HRH1 P35367 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA5B Q9Y2D0 1/20 0.46

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
SCHEMBL2142240 0.84 RAB9A (0.58) RAB9ANPC1SMN1; SMN2PTPRAPOLB
SCHEMBL21298 0.83 PTPRA (0.56) RAB9ANPC1SMN1; SMN2PTPRAPOLB
SCHEMBL29676689 0.83 PTPRA (0.56) RAB9ANPC1SMN1; SMN2PTPRAPOLB
Benzene SCHEMBL11747977 0.83 PTPRA (0.56) RAB9ANPC1SMN1; SMN2PTPRAPOLB
SCHEMBL988403 0.81 PTPRA (0.55) RAB9ANPC1SMN1; SMN2PTPRAPOLB
Hydrochloric Acid SCHEMBL334937 0.81 PTPRA (0.55) RAB9ANPC1SMN1; SMN2PTPRAPOLB
SCHEMBL5432067 0.81 RAB9A (0.54) RAB9ANPC1SMN1; SMN2PTPRAPOLB
SCHEMBL904686 0.81 RAB9A (0.59) RAB9ANPC1SMN1; SMN2PTPRAPOLB
SCHEMBL21909733 0.81 RAB9A (0.54) RAB9ANPC1SMN1; SMN2PTPRAPOLB
Water SCHEMBL5531145 0.81 PTPRA (0.55) RAB9ANPC1SMN1; SMN2PTPRAPOLB

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150322094-A1 USE OF SUBSTITUTED 2,3-DIHYDRO-1-BENZOFURAN-4-CARBOXYLIC ACIDS OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2015-11-12 US disclosed
EP-2892343-A1 USE OF SUBSTITUTED 2,3-DIHYDRO-1-BENZOFURAN-4-CARBOXYLIC ACIDS OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS Bayer CropScience AG (DE) 2015-07-15 EP disclosed
WO-2014037349-A1 USE OF SUBSTITUTED 2,3-DIHYDRO-1-BENZOFURAN-4-CARBOXYLIC ACIDS OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2014-03-13 WO disclosed
US-20050130941-A1 Methods of treating alzheimer's disease PHARMACIA & UPJOHN COMPANY LLC 2005-06-16 US disclosed
EP-1392315-A1 METHODS OF TREATING ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-03-03 EP disclosed
WO-2002100410-A1 METHODS OF TREATING ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-12-19 WO disclosed
JP-2002241391-A ERYTHROMYCIN A DERIVATIVE TAISHO PHARMACEUT CO LTD 2002-08-28 JP disclosed
US-5804565-A ANTIBIOTIC EFFECTIVE AGAINST HAEMOPHILUS INFLUENZAE TAISHO PHARMACEUTICAL CO., LTD. (JP) 1998-09-08 US disclosed
US-5753652-A Antiretroviral hydrazine derivatives NOVARTIS CORPORATION (US) 1998-05-19 US disclosed
WO-1998013373-A1 ERYTHROMYCIN A DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 1998-04-02 WO disclosed
EP-0604368-B1 Anti retroviral hydrazine derivatives CIBA GEIGY AG (CH) 1996-09-18 EP disclosed
EP-0604368-A1 Anti retroviral hydrazine derivatives CIBA-GEIGY AG (CH) 1994-06-29 EP disclosed
US-4101464-A Process for preparing foamed solids using two or more azo compounds PENNWALT CORPORATION (US) 1978-07-18 US disclosed
US-4029615-A AZO COMPOUNDS PENNWALT CORPORATION (US) 1977-06-14 US disclosed
US-3993609-A ACID SENSITIVE AZO PROMOTERS PENNWALT CORPORATION (US) 1976-11-23 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 (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-20150322094-A1 USE OF SUBSTITUTED 2,3-DIHYDRO-1-BENZOFURAN-4-CARBOXYLIC ACIDS OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS CAT, HSF1, HPD RAB9A 3029/4885NPC1 3919/4885SMN1; SMN2 4550/4885
US-20050130941-A1 Methods of treating alzheimer's disease BACE1, PSEN1, BACE2 RAB9A 362/4885NPC1 429/4885SMN1; SMN2 1200/4885

“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.