SCHEMBL19783355

SCHEMBL19783355

COC(=O)c1cc(OC)nc2sc(Br)nc12

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 7/20 0.46
KDM4E B2RXH2 5/20 0.46
HPGD P15428 2/20 0.42
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
CYP1A2 P05177 1/20 0.37
BACE1 P56817 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL30189726 1.00 L3MBTL1 (0.50) L3MBTL1ALDH1A1KDM4EHPGDKMT2A
SCHEMBL30189925 0.84 ALDH1A1 (0.45) L3MBTL1ALDH1A1KDM4EHPGDKMT2A
SCHEMBL19782957 0.84 ALDH1A1 (0.45) L3MBTL1ALDH1A1KDM4EHPGDKMT2A
SCHEMBL19783074 0.74 RECQL (0.38) L3MBTL1ALDH1A1KDM4EKMT2ASMN1; SMN2
SCHEMBL30189475 0.74 RECQL (0.38) L3MBTL1ALDH1A1KDM4EKMT2ASMN1; SMN2
SCHEMBL22392569 0.73 BACE1 (0.44) ALDH1A1KDM4EHPGDKMT2ACYP1A2
SCHEMBL30421536 0.73 BACE1 (0.44) ALDH1A1KDM4EHPGDKMT2ACYP1A2
SCHEMBL19782745 0.73 NPC1 (0.41) L3MBTL1ALDH1A1KDM4EHPGDKMT2A
SCHEMBL30189614 0.73 PDE4A (0.36) ALDH1A1KDM4EMAPT
SCHEMBL19782952 0.73 PDE4A (0.36) ALDH1A1KDM4EMAPT

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 L3MBTL1 1998/4885ALDH1A1 1598/4885KDM4E 2420/4885
US-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS F2, F2RL3, PF4 L3MBTL1 1728/4885ALDH1A1 1618/4885KDM4E 1865/4885
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS F2, F2RL3, F12 L3MBTL1 1998/4885ALDH1A1 1598/4885KDM4E 2420/4885

“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.