SCHEMBL10890872

SCHEMBL10890872

C=CCN1C(=O)CSC1=NN=C1SC(COP(=O)(O)O)C(=O)N1C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.40
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ MAPT P10636 1/20 0.37
▸ RECQL P46063 1/20 0.36
▸ POLB P06746 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ GAA P10253 1/20 0.30

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
SCHEMBL10890866 0.92 LMNA (0.39) LMNATSHRMAPK1ALDH1A1MAPT
SCHEMBL11200754 0.90 ALDH1A1 (0.39) LMNATSHRMAPK1ALDH1A1MAPT
SCHEMBL10899048 0.84 ALDH1A1 (0.40) LMNAALDH1A1MAPTRECQLPOLB
SCHEMBL9493016 0.80 LMNA (0.50) LMNATSHRMAPK1ALDH1A1MAPT
SCHEMBL9493012 0.80 LMNA (0.50) LMNATSHRMAPK1ALDH1A1MAPT
SCHEMBL9493024 0.79 LMNA (0.40) LMNATSHRMAPK1ALDH1A1MAPT
Phosphoric Acid SCHEMBL11090384 0.77 LMNA (0.49) LMNATSHRMAPK1ALDH1A1MAPT
SCHEMBL10881231 0.77 LMNA (0.39) LMNATSHRMAPK1ALDH1A1MAPT
SCHEMBL10899040 0.75 ALDH1A1 (0.41) LMNAALDH1A1MAPTRECQLPOLB
SCHEMBL9494278 0.74 LMNA (0.52) LMNATSHRMAPK1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0085275-A1 Substituted thiazolidinylic esters of mineral acids CIBA-GEIGY AG (CH) 1983-08-10 — — EP claimed
US-4582841-A ANTITUMOR AND -CARCINOGENIC AGENTS CIBA-GEIGY CORPORATION (US) 1986-04-15 — — US disclosed
US-4489069-A ANTITUMOR CIBA-GEIGY AG (CH) 1984-12-18 — — US disclosed
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