SCHEMBL6415745

SCHEMBL6415745

Cc1nc(N)nc(Cl)c1Cc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.68
TLR8 Q9NR97 4/20 0.55
KDM4E B2RXH2 1/20 0.51
HPGD P15428 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PLA2G2A P14555 1/20 0.49
ADCY10 Q96PN6 2/20 0.47
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 1/20 0.45
CDC7 O00311 1/20 0.44
DBF4 Q9UBU7 1/20 0.44
TLR7 Q9NYK1 3/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL7606821 0.88 KDM4E (0.58) NPSR1TLR8KDM4EHPGDSMN1; SMN2
SCHEMBL10310928 0.88 TLR8 (0.61) NPSR1TLR8HPGDALDH1A1CDC7
SCHEMBL855005 0.84 NPSR1 (0.69) NPSR1TLR8KDM4EHPGDSMN1; SMN2
SCHEMBL13686467 0.83 CYP2D6 (0.54) NPSR1KDM4EHPGDSMN1; SMN2ADCY10
SCHEMBL1900091 0.83 CYP2D6 (0.59) NPSR1TLR8ALDH1A1CDC7DBF4
SCHEMBL853400 0.81 NPSR1 (1.00) NPSR1KDM4EHPGDSMN1; SMN2PLA2G2A
SCHEMBL2846939 0.80 NPSR1 (0.64) NPSR1TLR8KDM4EHPGDSMN1; SMN2
SCHEMBL16229338 0.80 KDM4E (0.48) NPSR1TLR8KDM4EHPGDSMN1; SMN2
SCHEMBL6420389 0.80 TLR8 (0.55) NPSR1TLR8HPGDPLA2G2AALDH1A1
SCHEMBL16229319 0.80 KDM4E (0.48) NPSR1KDM4EHPGDSMN1; SMN2ADCY10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180155298-A1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS Apros Therapeutics, Inc. 2018-06-07 US disclosed
CN-1255414-C 2,4- dichlorophenoxy acetalimide derivatives of dithiazo pyridine with herbicidal activity and method for preparation thereof UNIV SHANGHAI (CN) 2006-05-10 CN disclosed
US-6951866-B2 Bicyclic pyrimidine compounds and therapeutic use thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-10-04 US disclosed
CN-1521169-A 2,4- dichlorophenoxy acetalimide derivatives of dithiazo pyridine with herbicidal activity and method for preparation thereof 上海师范大学 2004-08-18 CN disclosed
EP-1110951-B1 PYRIMIDINE DERIVATIVES SUMITOMO PHARMA (JP) 2004-05-19 EP disclosed
US-20030105323-A1 Pyrimidine derivative SUMITOMO PHARMACEUTICALS COMPANY LIMITED 2003-06-05 US disclosed
US-6458798-B1 HAS AN INHIBITORY ACTIVITY OF PRODUCTION OF TH2 TYPE CYTOKINES SUCH AS IL-4, IL-5, ETC., AND IS USEFUL AS AN THERAPEUTIC AGENT FOR ALLERGIC DISEASES, AUTOIMMUNE DISEASES SUCH AS SYSTEMIC LUPUS ERYTHEMATHOSUS, ETC., AND ACQUIRED SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-10-01 US disclosed
EP-1110951-A1 PYRIMIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-06-27 EP 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-20180155298-A1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS MAVS, TLR7, STING1 NPSR1 3949/4885TLR8 16/4885KDM4E 3029/4885
US-20030105323-A1 Pyrimidine derivative IL5, IL4, IL15 NPSR1 1358/4885TLR8 209/4885KDM4E 1077/4885

“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.