SCHEMBL7423974

SCHEMBL7423974

CCCC#Cc1cccc(C(=O)OC)c1NC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.39
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
CYP2C19 P33261 4/20 0.38
CYP1A2 P05177 3/20 0.38
HSD17B10 Q99714 5/20 0.38
LMNA P02545 4/20 0.38
KDM4E B2RXH2 4/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
APEX1 P27695 1/20 0.38
ALDH1A1 P00352 5/20 0.37
TSHR P16473 1/20 0.36
CFTR P13569 1/20 0.36
CXCR5 P32302 1/20 0.35

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
SCHEMBL16783400 0.83 LMNA (0.46) TDP1KMT2AGAASMN1; SMN2CYP2C19
SCHEMBL7424407 0.81 KMT2A (0.43) KMT2AGAASMN1; SMN2CYP2C19CYP1A2
SCHEMBL27500158 0.77 KDM4E (0.38) KMT2AGAASMN1; SMN2CYP2C19CYP1A2
SCHEMBL3177998 0.75 CYP2C19 (0.52) TDP1KMT2AGAASMN1; SMN2CYP2C19
SCHEMBL6139643 0.74 CYP2C19 (0.45) TDP1KMT2AGAASMN1; SMN2CYP2C19
SCHEMBL23320324 0.73 CA12 (0.40) TDP1KMT2ASMN1; SMN2CYP2C19CYP1A2
SCHEMBL7427803 0.73 ALDH1A1 (0.53) KMT2AGAASMN1; SMN2HSD17B10LMNA
SCHEMBL7424707 0.73 ALDH1A1 (0.50) KMT2AGAASMN1; SMN2HSD17B10LMNA
SCHEMBL7422995 0.72 LMNA (0.59) KMT2ASMN1; SMN2CYP1A2HSD17B10LMNA
SCHEMBL22426668 0.72 NR4A2 (0.46) KMT2ASMN1; SMN2CYP1A2HSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820441-B1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 2002-06-26 EP disclosed
US-6358992-B1 Method of inhibiting neoplastic cells with indole derivatives CELL PATHWAYS, INC. 2002-03-19 US disclosed
US-6069156-A Indole derivatives as cGMP-PDE inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-05-30 US disclosed
EP-0946519-A1 BENZAMIDE DERIVATIVES HAVING A VASOPRESSIN ANTAGONISTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-10-06 EP disclosed
WO-1998024771-A1 BENZAMIDE DERIVATIVES HAVING A VASOPRESSIN ANTAGONISTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-06-11 WO disclosed
EP-0820441-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-28 EP disclosed
WO-1996032379-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-17 WO disclosed