SCHEMBL29574646

SCHEMBL29574646

O=C(O)c1cnccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.58
ROCK1 Q13464 1/20 0.58
KDM4C Q9H3R0 7/20 0.53
ALDH1A1 P00352 4/20 0.53
TDP1 Q9NUW8 2/20 0.53
KDM6B O15054 2/20 0.53
KDM4D Q6B0I6 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
KDM4A O75164 1/20 0.53
MAPT P10636 1/20 0.53
THRB P10828 1/20 0.53
KMT2A Q03164 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
TP53 P04637 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
KDM5A P29375 1/20 0.43
KDM5B Q9UGL1 1/20 0.43
NAPRT Q6XQN6 1/20 0.43

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
SCHEMBL7533 1.00 ROCK2 (0.58) ROCK2ROCK1KDM4CALDH1A1TDP1
Hydrochloric Acid SCHEMBL1942270 0.98 ROCK2 (0.56) ROCK2ROCK1KDM4CALDH1A1TDP1
Hydrochloric Acid SCHEMBL17143441 0.98 ROCK2 (0.56) ROCK2ROCK1KDM4CALDH1A1TDP1
SCHEMBL8686759 0.88 ROCK2 (0.47) ROCK2ROCK1KDM4CALDH1A1TDP1
SCHEMBL30465597 0.83 ROCK2 (0.58) ROCK2ROCK1KDM4CALDH1A1TDP1
SCHEMBL116912 0.83 KDM4C (0.59) ROCK2ROCK1KDM4CALDH1A1TDP1
SCHEMBL587010 0.83 ROCK2 (0.58) ROCK2ROCK1KDM4CALDH1A1TDP1
SCHEMBL15514423 0.83 ROCK2 (0.58) ROCK2ROCK1KDM4CALDH1A1TDP1
SCHEMBL30933589 0.83 KDM4C (0.59) ROCK2ROCK1KDM4CALDH1A1TDP1
Hydrochloric Acid SCHEMBL2432397 0.81 ROCK2 (0.56) ROCK2ROCK1KDM4CALDH1A1TDP1

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
EP-4448510-A1 INHIBITORS OF MET KINASE Kinnate Biopharma Inc. (US) 2024-10-23 EP disclosed
WO-2023114809-A1 INHIBITORS OF MET KINASE KINNATE BIOPHARMA INC. (US) 2023-06-22 WO disclosed
EP-3976608-A1 THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS Ideaya Biosciences, Inc. (US) 2022-04-06 EP disclosed