SCHEMBL7984640

SCHEMBL7984640

CCc1nn(CC2CC2)c2cc(C(=O)O)ccc12

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 11/20 0.61
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
PTGER4 P35408 3/20 0.41
TEAD1 P28347 1/20 0.40
TEAD4 Q15561 1/20 0.40
TEAD2 Q15562 1/20 0.40
KDM4C Q9H3R0 2/20 0.40
P2RY14 Q15391 2/20 0.39

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
SCHEMBL3616599 0.90 SLC22A12 (0.49) SLC22A12MEN1KMT2AKDM4CP2RY14
SCHEMBL7970829 0.87 SLC22A12 (0.47) SLC22A12MEN1KMT2APTGER4
SCHEMBL3604441 0.83 SLC22A12 (0.43) SLC22A12MEN1KMT2APTGER4
SCHEMBL3597241 0.82 SLC22A12 (0.43) SLC22A12MEN1NPC1RAB9AKMT2A
SCHEMBL3597239 0.82 SLC22A12 (0.43) SLC22A12MEN1NPC1RAB9AKMT2A
SCHEMBL3604440 0.82 SLC22A12 (0.43) SLC22A12MEN1KMT2A
SCHEMBL28772830 0.80 SLC22A12 (0.39) SLC22A12KDM4C
SCHEMBL8358690 0.79 PDE4A (0.59) SLC22A12
SCHEMBL24975827 0.78 SLC22A12 (0.46) SLC22A12PTGER4KDM4C
SCHEMBL7379307 0.78 TEAD1 (0.53) SLC22A12MEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1234031-A Indazole derivatives and their use as inhibitors of phosphodiesterase (PDE) type IV and the prodn. of tumor necrosis factor (TNF) PFIZER (US) 1999-11-03 CN claimed
US-6262040-B1 Indazole derivatives and their use as inhibitors of phosphodiesterase (PDE) type IV and the production of tumor necrosis factor (TNF) PFIZER INC 2001-07-17 US disclosed
CN-1234031-A Indazole derivatives and their use as inhibitors of phosphodiesterase (PDE) type IV and the prodn. of tumor necrosis factor (TNF) PFIZER (US) 1999-11-03 CN disclosed