SCHEMBL14355085

SCHEMBL14355085

c1ccc(Nc2ccc(-c3ccncc3)nc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ WNT3A P56704 2/20 0.49
▸ CYP11B1 P15538 1/20 0.49
▸ CYP11B2 P19099 1/20 0.49
▸ PTPN2 P17706 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ PTGS1 P23219 1/20 0.45
▸ SLC6A2 P23975 1/20 0.45
▸ PTGS2 P35354 1/20 0.45
▸ HTR2B P41595 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ MAPT P10636 3/20 0.44
▸ CLK1 P49759 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
SCHEMBL22589209 0.89 ALDH1A1 (0.52) WNT3ACYP11B1CYP11B2PTPN2PTPN1
SCHEMBL14355086 0.86 RAB9A (0.56) SMN1; SMN2CYP11B1CYP11B2PTPN1ALDH1A1
SCHEMBL14355087 0.83 ABL1 (0.44) SMN1; SMN2WNT3ACYP11B1CYP11B2PTPN2
SCHEMBL4630942 0.79 NOTUM (0.61) SMN1; SMN2ALDH1A1MAPK1TDP1ALOX15
SCHEMBL14355084 0.77 CYP11B1 (0.45) SMN1; SMN2WNT3ACYP11B1CYP11B2PTPN2
SCHEMBL17465465 0.76 PTPN2 (0.45) SMN1; SMN2WNT3ACYP11B1CYP11B2PTPN2
SCHEMBL14378766 0.75 PTPN1 (0.81) SMN1; SMN2WNT3APTPN2PTPN1RAB9A
SCHEMBL21012420 0.75 NOTUM (0.68) SMN1; SMN2ALDH1A1MAPK1TDP1ALOX15
SCHEMBL16200517 0.75 HPGDS (0.50) SMN1; SMN2PTPN2PTPN1ALDH1A1MAPK1
SCHEMBL1720986 0.74 HSD17B10 (0.67) SMN1; SMN2ALDH1A1MAPK1TDP1ALOX15

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
WO-2014057874-A1 FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT 東レ株式会社 (JP) 2014-04-17 — — WO disclosed
US-7301029-B2 Bipyridine Derivatives FUJIFILM FINECHEMICALS CO., LTD. (JP) 2007-11-27 — — US disclosed
US-7301029-B2 Bipyridine Derivatives FUJIFILM FINECHEMICALS CO., LTD. (JP) 2007-11-27 — — US disclosed
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