SCHEMBL19784752

SCHEMBL19784752

CCOC(=O)c1ccc(-c2nn(CC)c3ccccc23)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 2/20 0.79
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 2/20 0.52
LMNA P02545 1/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
KMT2A Q03164 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HSD17B10 Q99714 2/20 0.51
ELANE P08246 7/20 0.49
RORC P51449 1/20 0.49
GAA P10253 1/20 0.49
RARA P10276 1/20 0.49
RARB P10826 1/20 0.49
RARG P13631 1/20 0.49
MAPT P10636 1/20 0.48
TSHR P16473 1/20 0.47
MPI P34949 1/20 0.46
EP300 Q09472 1/20 0.46
PHOSPHO1 Q8TCT1 1/20 0.46

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
SCHEMBL363569 0.88 F2RL3 (1.00) F2RL3KDM4EALDH1A1LMNAHPGD
SCHEMBL29403731 0.88 F2RL3 (1.00) F2RL3KDM4EALDH1A1LMNAHPGD
SCHEMBL27512690 0.86 F2RL3 (0.80) F2RL3KDM4EALDH1A1LMNAHPGD
SCHEMBL23551968 0.86 F2RL3 (0.69) F2RL3KDM4EALDH1A1HPGDKMT2A
SCHEMBL4478363 0.84 F2RL3 (0.74) F2RL3KDM4EALDH1A1LMNAHPGD
SCHEMBL17322911 0.78 HSD17B10 (0.64) F2RL3KDM4EALDH1A1LMNAHPGD
SCHEMBL15631894 0.77 ALDH1A1 (0.76) F2RL3KDM4EALDH1A1LMNAHPGD
SCHEMBL7488323 0.76 F2RL3 (0.78) F2RL3KDM4EALDH1A1LMNAHPGD
SCHEMBL6352575 0.73 KDM4E (0.59) F2RL3KDM4EALDH1A1LMNAHPGD
SCHEMBL31426904 0.73 KDM4E (0.59) F2RL3KDM4EALDH1A1LMNAHPGD

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
EP-3484881-B1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2020-04-29 EP disclosed
WO-2018013770-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-01-18 WO disclosed