SCHEMBL24118292

SCHEMBL24118292

C=C(CCNC(=O)c1sc(C)nc1C)C(C)C(=O)Nc1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.46
▸ RECQL P46063 1/20 0.46
▸ SCD O00767 2/20 0.40
▸ F10 P00742 1/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ GAA P10253 2/20 0.37

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
SCHEMBL24117960 0.82 HIF1A (0.47) RAB9AKMT2ANPC1SMN1; SMN2MEN1
SCHEMBL24118252 0.80 GCGR (0.38) RAB9ARECQLKMT2ANPC1SMN1; SMN2
SCHEMBL24118612 0.78 L3MBTL1 (0.40) RAB9AKMT2ANPC1SMN1; SMN2MEN1
SCHEMBL24118113 0.78 KMT2A (0.41) RAB9AKMT2ANPC1SMN1; SMN2MEN1
SCHEMBL24118254 0.78 FPR2 (0.48) RAB9ARECQLKMT2AMEN1ALDH1A1
SCHEMBL24118272 0.77 MEN1 (0.44) RECQLKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL24118074 0.77 SMN1; SMN2 (0.41) RAB9AKMT2ANPC1SMN1; SMN2MEN1
SCHEMBL24117971 0.76 KDM4E (0.48) RAB9AKMT2ANPC1SMN1; SMN2MEN1
SCHEMBL24118115 0.76 SCN10A (0.43) KMT2ASMN1; SMN2MEN1HPGDALDH1A1
SCHEMBL24118386 0.75 MEN1 (0.42) KMT2AMEN1L3MBTL1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210393600-A1 Novel [1.1.1] Bicyclo Compounds as Indoleamine 2,3-Dioxygenase Inhibitors MERCK SHARP & DOHME CORP. (US) 2021-12-23 — — US 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 (1 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-20210393600-A1 Novel [1.1.1] Bicyclo Compounds as Indoleamine 2,3-Dioxygenase Inhibitors IDO1, IDO2, TPH1 RAB9A 2866/4885RECQL 1249/4885SCD 1019/4885

“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.

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