SCHEMBL7189346

SCHEMBL7189346

CN1C(=O)C(c2cn(C)c3ccccc23)C(c2cn(C)c3ccccc23)C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
LMNA P02545 3/20 0.51
KMT2A Q03164 2/20 0.51
USP2 O75604 1/20 0.51
IMPDH2 P12268 2/20 0.46
POLB P06746 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CCNE2 O96020 1/20 0.45
CDK4 P11802 1/20 0.45
CCND1 P24385 1/20 0.45
CCNE1 P24864 1/20 0.45
CDK2 P24941 1/20 0.45
GPR84 Q9NQS5 1/20 0.44
CCNT1 O60563 1/20 0.44
CDK9 P50750 1/20 0.44
HTT P42858 1/20 0.44
NR4A2 P43354 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GSK3B P49841 2/20 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
SCHEMBL6951037 0.92 KMT2A (0.46) ALDH1A1LMNAKMT2AUSP2IMPDH2
SCHEMBL7188377 0.86 CCNT1 (0.49) ALDH1A1LMNAKMT2AUSP2POLB
SCHEMBL1395791 0.79 OPA1 (0.53) ALDH1A1LMNAKMT2AUSP2MAPT
SCHEMBL7195540 0.75 ADRB2 (0.48) ALDH1A1KMT2APOLBHTTKDM4E
SCHEMBL17067795 0.73 ALDH1A1 (0.51) ALDH1A1LMNAKMT2AUSP2IMPDH2
SCHEMBL6663571 0.72 LMNA (0.51) ALDH1A1LMNAKMT2AUSP2IMPDH2
SCHEMBL10371558 0.72 LMNA (0.48) ALDH1A1LMNAKMT2AUSP2IMPDH2
SCHEMBL22612115 0.72 DDB1 (0.56) ALDH1A1LMNAKMT2AUSP2POLB
SCHEMBL22623681 0.72 DDB1 (0.56) ALDH1A1LMNAKMT2AUSP2POLB
SCHEMBL27975853 0.71 ALDH1A1 (0.50) ALDH1A1LMNAKMT2AUSP2IMPDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6589977-B1 Bisindolylpyrrole derivatives represented by general formula (I) which are useful in inhibiting cell death and expected as being useful as preventives and remedies for the progress of various diseases in the progress and worsening of which cell SAGAMI CHEMICAL RESEARCH CENTER (JP) 2003-07-08 US disclosed
EP-1152002-A1 PYRROLE DERIVATIVES AND CELL DEATH INHIBITORS SAGAMI CHEMICAL RESEARCH CENTER (JP) 2001-11-07 EP disclosed