SCHEMBL19782540

SCHEMBL19782540

Oc1cc(F)c2nc(Br)sc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
RAB9A P51151 7/20 0.42
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
MAPT P10636 3/20 0.42
PKM P14618 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
NPC1 O15118 7/20 0.38
LMNA P02545 4/20 0.38
GAA P10253 4/20 0.38
HPGD P15428 2/20 0.37
HTT P42858 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MCL1 Q07820 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NSD1 Q96L73 1/20 0.36
SMN1; SMN2 Q16637 5/20 0.36
AGTR1 P30556 1/20 0.34
OPRK1 P41145 1/20 0.34
HSD17B1 P14061 2/20 0.33

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
SCHEMBL30189617 1.00 ALDH1A1 (0.42) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL27986669 0.82 ALDH1A1 (0.40) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL19783572 0.80 RAB9A (0.62) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL17856111 0.80 ALDH1A1 (0.44) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL24603433 0.77 ALDH1A1 (0.46) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL19782753 0.77 HSD17B10 (0.42) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL30626900 0.77 ALDH1A1 (0.46) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL2274532 0.77 RAB9A (0.39) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL22395360 0.75 GAA (0.43) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL19783180 0.73 ALDH1A1 (0.42) ALDH1A1RAB9AMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12060347-B2 Bicyclic heteroaryl substituted compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-08-13 US disclosed
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN disclosed
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-06-03 US disclosed
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-06-03 US disclosed
EP-3484878-B1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2020-08-19 EP disclosed
US-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BISTOL MYERS SQUIBB COMPANY (US) 2019-09-26 US disclosed
US-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BISTOL MYERS SQUIBB COMPANY (US) 2019-09-26 US disclosed
WO-2018013774-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-01-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12060347-B2 Bicyclic heteroaryl substituted compounds F2, F2RL3, F12 ALDH1A1 1598/4885RAB9A 748/4885MEN1 1492/4885
US-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS F2, F2RL3, PF4 ALDH1A1 1618/4885RAB9A 667/4885MEN1 1767/4885
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS F2, F2RL3, F12 ALDH1A1 1598/4885RAB9A 748/4885MEN1 1492/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.