SCHEMBL9259880

SCHEMBL9259880

O=C1NCc2c1c1c3cc(O)ccc3[nH]c1c1[nH]c3ccc(O)cc3c21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 11/20 1.00
PRKCA P17252 3/20 0.88
MAP3K5 Q99683 2/20 0.88
PRKCQ Q04759 2/20 0.88
PRKCD Q05655 2/20 0.88
IKBKB O14920 1/20 0.88
PIM1 P11309 1/20 0.88
ROCK1 Q13464 1/20 0.88
GLI1 P08151 2/20 0.75
GLI2 P10070 2/20 0.75
PRKD3 O94806 1/20 0.66
PRKCG P05129 1/20 0.66
PRKCB P05771 1/20 0.66
CDK4 P11802 1/20 0.66
CTRB1 P17538 1/20 0.66
PRKACA P17612 1/20 0.66
PRKACG P22612 1/20 0.66
PRKACB P22694 1/20 0.66
CCND1 P24385 1/20 0.66
PRKCH P24723 1/20 0.66

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
SCHEMBL9266338 0.83 PARP1 (0.75) ROCK2PRKCAMAP3K5PRKCQPRKCD
SCHEMBL9265092 0.83 PARP1 (0.75) ROCK2PRKCAMAP3K5PRKCQPRKCD
SCHEMBL9545490 0.83 ROCK2 (0.88) ROCK2PRKCAMAP3K5PRKCQPRKCD
SCHEMBL22567014 0.83 ROCK2 (0.71) ROCK2PRKCAMAP3K5PRKCQPRKCD
SCHEMBL9263673 0.80 ROCK2 (0.87) ROCK2PRKCAMAP3K5PRKCQPRKCD
Staurosporinone SCHEMBL29389399 0.80 MAP3K11 (1.00) ROCK2PRKCAMAP3K5PRKCQPRKCD
Staurosporinone SCHEMBL29374983 0.80 MAP3K11 (1.00) ROCK2PRKCAMAP3K5PRKCQPRKCD
Staurosporinone SCHEMBL5440281 0.80 MAP3K11 (1.00) ROCK2PRKCAMAP3K5PRKCQPRKCD
SCHEMBL8120620 0.79 ROCK2 (1.00) ROCK2GLI1GLI2WEE1CHEK1
SCHEMBL9545347 0.76 MYLK (0.73) ROCK2PRKCAMAP3K5PRKCQPRKCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993024490-A1 USE OF INDOLOCARBAZOLS IN AIDS TREATMENT Gödecke Aktiengesellschaft (DE) 1993-12-09 WO claimed
US-5438050-A Indolocarbazole derivatives, processes for their preparation and compositions containing them GODECKE AKTIENGESELLSCHAFT (DE) 1995-08-01 US disclosed
WO-1993024490-A1 USE OF INDOLOCARBAZOLS IN AIDS TREATMENT Gödecke Aktiengesellschaft (DE) 1993-12-09 WO disclosed
EP-0370236-B1 INDOLOCARBAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS GÖDECKE AKTIENGESELLSCHAFT (DE) 1991-12-27 EP disclosed
EP-0370236-A1 Indolocarbazole derivatives, processes for their preparation and their use as medicaments GÖDECKE AKTIENGESELLSCHAFT (DE) 1990-05-30 EP disclosed