SCHEMBL7967732

SCHEMBL7967732

CC(=O)c1c(Cl)c(-c2cccnc2)n2c1C(O)CCC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 5/20 0.39
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 2/20 0.36
BLM P54132 1/20 0.36
ACHE P22303 1/20 0.36
ALOX15 P16050 1/20 0.36
GRM5 P41594 1/20 0.36
CYP3A4 P08684 2/20 0.36
RECQL P46063 1/20 0.36
CHRNA7 P36544 2/20 0.36
CHRNB2 P17787 2/20 0.36
CHRNB4 P30926 2/20 0.36
CHRNA3 P32297 2/20 0.36
CHRNA4 P43681 2/20 0.36
CHRNA2 Q15822 2/20 0.36
CYP2A6 P11509 2/20 0.36
LMNA P02545 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL8325325 0.90 CYP11B2 (0.39) CYP11B2ALDH1A1KDM4EBLMACHE
SCHEMBL7964580 0.89 CYP11B2 (0.43) CYP11B2ALDH1A1KCNH2FPR1FPR2
SCHEMBL2158122 0.89 CYP11B2 (0.43) CYP11B2ALDH1A1KCNH2FPR1FPR2
SCHEMBL7964582 0.89 CYP11B2 (0.43) CYP11B2ALDH1A1KCNH2FPR1FPR2
SCHEMBL7962101 0.89 NR4A2 (0.40) CYP11B2ALDH1A1KDM4EBLMALOX15
SCHEMBL7961904 0.88 CYP11B2 (0.39) CYP11B2ALDH1A1KDM4EBLMACHE
SCHEMBL7962938 0.86 CYP11B2 (0.36) CYP11B2ALDH1A1KDM4ECYP3A4CHRNA7
SCHEMBL7963284 0.85 UCHL1 (0.40) CYP11B2ALDH1A1KDM4EBLMACHE
SCHEMBL7964875 0.84 CYP11B2 (0.37) CYP11B2ALDH1A1KDM4EBLMACHE
SCHEMBL8325141 0.81 KDM4E (0.39) CYP11B2ALDH1A1KDM4EBLMACHE

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
US-6207675-B1 FOR PROPHYLAXIS AND THERAPY OF DISEASES IN WHICH ARE INVOLVED VIRUSES OF THE HERPES FAMILY AND/OR CYTOKINES IN PARTICULAR TUMOR NERCOSIS FACTOR-ALPHA RHONE-POULENC RORER S.A. (FR) 2001-03-27 US claimed
EP-0946555-A1 PYRROLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Aventis Pharma S.A. (FR) 1999-10-06 EP claimed
WO-1998025925-A1 PYRROLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1998-06-18 WO claimed
US-6207675-B1 FOR PROPHYLAXIS AND THERAPY OF DISEASES IN WHICH ARE INVOLVED VIRUSES OF THE HERPES FAMILY AND/OR CYTOKINES IN PARTICULAR TUMOR NERCOSIS FACTOR-ALPHA RHONE-POULENC RORER S.A. (FR) 2001-03-27 US disclosed