SCHEMBL9706192

SCHEMBL9706192

Cc1ccc2nc3[nH]c4ccc(Cl)cc4c3nc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
CYP1A2 P05177 3/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
CASP1 P29466 3/20 0.47
CASP7 P55210 3/20 0.47
TP53 P04637 2/20 0.47
MAPK10 P53779 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
MAPK1 P28482 1/20 0.47
CYP2C19 P33261 1/20 0.47
GAA P10253 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 1/20 0.45
CHEK1 O14757 2/20 0.42
ALDH1A1 P00352 1/20 0.42
KDM4E B2RXH2 2/20 0.42
PLK4 O00444 1/20 0.41

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
SCHEMBL29412926 0.87 CYP1A2 (0.61) MAPTCYP1A2NPC1RAB9ACASP1
SCHEMBL24108671 0.87 CYP1A2 (0.61) MAPTCYP1A2NPC1RAB9ACASP1
SCHEMBL9706263 0.84 CASP1 (0.65) MAPTCYP1A2NPC1RAB9ACASP1
SCHEMBL9706300 0.83 MAPK1 (0.48) MAPTCYP1A2NPC1RAB9ACASP1
SCHEMBL8832035 0.81 NPC1 (0.71) MAPTCYP1A2NPC1RAB9ACASP1
SCHEMBL8832028 0.81 NPC1 (0.65) MAPTCYP1A2NPC1RAB9ACASP1
SCHEMBL19213940 0.77 NQO2 (0.55) MAPTCYP1A2RAB9ACASP1CASP7
SCHEMBL20685604 0.71 LMNA (0.56) MAPTCYP1A2NPC1RAB9AGAA
SCHEMBL9706105 0.70 MAPK1 (0.51) MAPTCYP1A2NPC1RAB9ACASP1
SCHEMBL12355722 0.69 NQO2 (0.70) MAPTCYP1A2RAB9ASMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238459-B1 SUBSTITUTED INDOLOQUINOXALINES Lundblad, Leif (SE) 1992-04-15 EP disclosed
US-4990510-A Viricides, anticancer agents LEIF LUNDBLAD (BE) 1991-02-05 US disclosed
EP-0238459-A1 Substituted indoloquinoxalines Lundblad, Leif (SE) 1987-09-23 EP disclosed
WO-1987004436-A1 SUBSTITUTED INDOLOQUINOXALINES LUNDBLAD, LEIF (SE) 1987-07-30 WO disclosed