SCHEMBL763929

SCHEMBL763929

Cc1nc2ncn(C)c2c(=O)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GDA Q9Y2T3 2/20 0.50
CYP3A4 P08684 2/20 0.49
PMP22 Q01453 2/20 0.49
MAPK1 P28482 1/20 0.49
ADORA2A P29274 2/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
BLM P54132 1/20 0.41
ADORA3 P0DMS8 2/20 0.39
RAB9A P51151 1/20 0.38
PARP1 P09874 4/20 0.36
PIK3CD O00329 1/20 0.36
POLB P06746 1/20 0.36
CNR1 P21554 1/20 0.36

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
SCHEMBL38660560 0.81 GDA (0.46) GDACYP3A4PMP22MAPK1ADORA2A
SCHEMBL21363401 0.81 GDA (0.49) GDACYP3A4PMP22MAPK1ADORA2A
SCHEMBL25547 0.81 GDA (0.49) GDACYP3A4PMP22MAPK1ADORA2A
SCHEMBL30819196 0.78 GDA (0.46) GDACYP3A4PMP22MAPK1ADORA2A
SCHEMBL17373192 0.78 GDA (0.50) GDACYP3A4PMP22MAPK1ADORA2A
SCHEMBL22166084 0.78 ADORA2A (0.48) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL8905241 0.76 BRD4 (0.40) GDACYP3A4PMP22MAPK1ADORA2A
Phosphoric Acid SCHEMBL28768404 0.74 EIF4E (0.46) GDACYP3A4PMP22MAPK1POLB
SCHEMBL21316712 0.73 ADORA2A (0.35) ADORA2AALDH1A1TSHRADORA3ADORA2B
Phosphoric Acid SCHEMBL20856962 0.73 EIF4E (0.46) GDACYP3A4PMP22MAPK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12497401-B2 Substituted tetrazoles as TRPA1 inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2025-12-16 US disclosed
EP-3768260-B1 OXADIAZOLE COMPOUNDS AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS HOFFMANN LA ROCHE (CH) 2025-10-08 EP disclosed
US-20250122184-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2025-04-17 US disclosed
US-12202824-B2 Oxadiazole transient receptor potential channel inhibitors GENENTECH, INC. (US) 2025-01-21 US disclosed
US-20240101561-A1 NOVEL TETRAZOLES BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2024-03-28 US disclosed
EP-4045053-B1 NOVEL TETRAZOLES BOEHRINGER INGELHEIM INT (DE) 2023-12-06 EP disclosed
US-11655245-B2 Oxadiazole transient receptor potential channel inhibitors GENENTECH, INC. (US) 2023-05-23 US disclosed
US-11655245-B2 Oxadiazole transient receptor potential channel inhibitors GENENTECH, INC. (US) 2023-05-23 US disclosed
US-11655245-B2 Oxadiazole transient receptor potential channel inhibitors GENENTECH, INC. (US) 2023-05-23 US disclosed
US-20230121700-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2023-04-20 US disclosed
US-20170340633-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2017-11-30 US disclosed
US-20170049772-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2017-02-23 US disclosed
US-9487772-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2016-11-08 US disclosed
US-8653077-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2014-02-18 US disclosed
US-8637533-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2014-01-28 US disclosed
US-8623881-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2014-01-07 US disclosed
US-8492389-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2013-07-23 US disclosed
US-20120172591-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2012-07-05 US disclosed
US-8138195-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2012-03-20 US disclosed
US-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2010-06-17 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 (10 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-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG GDA 1483/4885CYP3A4 3145/4885PMP22 3308/4885
US-20170340633-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG GDA 1483/4885CYP3A4 3145/4885PMP22 3308/4885
US-20170049772-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG GDA 1373/4885CYP3A4 3827/4885PMP22 2791/4885
US-12202824-B2 Oxadiazole transient receptor potential channel inhibitors TRPA1, TRPV1, TRPV3 GDA 4649/4885CYP3A4 865/4885PMP22 960/4885
US-11655245-B2 Oxadiazole transient receptor potential channel inhibitors TRPA1, TRPV1, P2RX3 GDA 4450/4885CYP3A4 843/4885PMP22 1180/4885
US-20120172591-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG GDA 1483/4885CYP3A4 3145/4885PMP22 3308/4885
US-20240101561-A1 NOVEL TETRAZOLES TRPA1, TRPV1, TRPV5 GDA 3807/4885CYP3A4 3309/4885PMP22 184/4885
US-20230121700-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, TRPV3 GDA 4649/4885CYP3A4 865/4885PMP22 960/4885
US-12497401-B2 Substituted tetrazoles as TRPA1 inhibitors TRPA1, TRPV1, TRPV2 GDA 3613/4885CYP3A4 2747/4885PMP22 168/4885
US-20250122184-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, TRPV3 GDA 4649/4885CYP3A4 865/4885PMP22 960/4885

“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.