SCHEMBL23506516

SCHEMBL23506516

C=Nc1cccnc1SCC(C)C

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ KMT2A Q03164 2/20 0.31
▸ GAA P10253 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31

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
SCHEMBL16214710 0.75 KMT2A (0.37) RAB9AALDH1A1KDM4ENPSR1L3MBTL1
SCHEMBL27254458 0.73 MAOA (0.40) RAB9ASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL15668887 0.72 KMT2A (0.42) RAB9ASMN1; SMN2ALDH1A1KDM4EL3MBTL1
SCHEMBL15669107 0.72 ALDH1A1 (0.35) RAB9ASMN1; SMN2ALDH1A1KDM4EPOLB
SCHEMBL15668691 0.70 ALDH1A1 (0.61) RAB9ASMN1; SMN2ALDH1A1KDM4EPOLB
Acetic Acid SCHEMBL28089005 0.68 ALDH1A1 (0.40) RAB9ASMN1; SMN2ALDH1A1L3MBTL1KMT2A
SCHEMBL28005595 0.67 KDM4E (0.42) ALDH1A1KDM4EKMT2AHPGDTSHR
SCHEMBL11922540 0.67 ALDH1A1 (0.45) RAB9ASMN1; SMN2ALDH1A1NPSR1L3MBTL1
SCHEMBL2608954 0.66 KMT2A (0.58) RAB9ASMN1; SMN2ALDH1A1KDM4EPOLB
SCHEMBL24057956 0.66 MAOA (0.37) RAB9ASMN1; SMN2ALDH1A1KDM4EPOLB

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
EP-3835322-A2 ANTI-B7-H3 ANTIBODIES AND ANTIBODY DRUG CONJUGATES AbbVie Inc. (US) 2021-06-16 — — EP disclosed
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