SCHEMBL31083985

SCHEMBL31083985

COC(=O)c1cccc(Nc2nc(Cl)nc3c2SCC3)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.49
▸ LMNA P02545 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ PDE5A O76074 1/20 0.46
▸ MAPT P10636 7/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ ROCK1 Q13464 1/20 0.43
▸ ABCG2 Q9UNQ0 2/20 0.43
▸ ABCB1 P08183 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ BRD4 O60885 1/20 0.43
▸ EP300 Q09472 1/20 0.43
▸ CREBBP Q92793 1/20 0.43
▸ NPC1 O15118 4/20 0.42
▸ RAB9A P51151 4/20 0.42

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
SCHEMBL13211477 0.89 HPGD (0.46) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL3938216 0.88 RHOA (0.46) MAPK1MAPTKDM4EMEN1KMT2A
SCHEMBL3517759 0.82 CCNT1 (0.49) TSHRHPGDSRC
SCHEMBL31469077 0.81 SYK (0.41) TP53TSHRMAPTSMN1; SMN2MEN1
SCHEMBL19624259 0.81 NFKB1 (0.51) LMNAMAPTSMN1; SMN2ABCG2ABCB1
SCHEMBL375687 0.78 PDE4B (0.44) MAPK1LMNAMAPTSMN1; SMN2KMT2A
SCHEMBL31083964 0.77 LMNA (0.47) MAPK1LMNATP53TSHRPDE5A
SCHEMBL31572377 0.75 PDE4B (0.44) MAPTMEN1KMT2AALDH1A1PDE4B
SCHEMBL2124418 0.74 NFKB1 (0.57) MAPK1LMNATP53TSHRPDE5A
SCHEMBL19867173 0.74 MAPT (0.54) MAPK1LMNATP53TSHRPDE5A

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-4674852-A1 PREPARATION METHOD FOR AND USE OF DIHYDROTHIENOPYRIMIDINE DERIVATIVE Innovstone Therapeutics Limited (CN) 2026-01-07 — — EP disclosed
WO-2024179493-A1 PREPARATION METHOD FOR AND USE OF DIHYDROTHIENOPYRIMIDINE DERIVATIVE 上海翊石医药科技有限公司 2024-09-06 — — WO disclosed
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