SCHEMBL7808491

SCHEMBL7808491

COCCNc1ccc(N)cc1-c1ccc[nH]1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.41
NCF1 P14598 2/20 0.40
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
CDK2 P24941 6/20 0.36
LMNA P02545 1/20 0.34
UTS2R Q9UKP6 1/20 0.34
KCNN4 O15554 1/20 0.33
HCAR3 P49019 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MALT1 Q9UDY8 1/20 0.33
RXFP1 Q9HBX9 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
SCHEMBL7809829 0.92 PTGER4 (0.40) PTGER4NCF1ALDH1A1MAPTCDK2
SCHEMBL7809613 0.82 CDK2 (0.47) CDK2KDM4E
SCHEMBL7805942 0.80 CDK2 (0.41) ALDH1A1MAPTCDK2KDM4E
SCHEMBL6570689 0.78 PTGER4 (0.48) PTGER4NCF1ALDH1A1MAPTLMNA
SCHEMBL6572960 0.78 PTGER4 (0.51) PTGER4NCF1ALDH1A1MAPTKCNN4
SCHEMBL6572005 0.77 PTGER4 (0.50) PTGER4NCF1ALDH1A1MAPTLMNA
SCHEMBL6572456 0.77 PTGER4 (0.50) PTGER4NCF1ALDH1A1MAPTLMNA
SCHEMBL6574666 0.77 PTGER4 (0.50) PTGER4NCF1ALDH1A1MAPTLMNA
SCHEMBL7808522 0.77 PDPK1 (0.35) ALDH1A1CDK2LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL6572054 0.77 PTGER4 (0.50) PTGER4NCF1ALDH1A1MAPTKCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0943614-B1 Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives WELLA AG (DE) 2001-12-12 EP disclosed
US-6042620-A FOR DYEING KERATIN FIBERS SUCH AS HAIR WELLA AG (DE) 2000-03-28 US disclosed
EP-0943614-A2 Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives Wella Aktiengesellschaft (DE) 1999-09-22 EP disclosed