SCHEMBL11656567

SCHEMBL11656567

O=C(SCc1ccc(Cl)c(Cl)c1)C1CC1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.53
PTPRG P23470 3/20 0.44
PTPRC P08575 2/20 0.43
MAPT P10636 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SIGMAR1 Q99720 2/20 0.41
KCNH2 Q12809 1/20 0.41
PNMT P11086 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
TSHR P16473 1/20 0.41
S1PR5 Q9H228 3/20 0.40
KMT2A Q03164 2/20 0.40
S1PR1 P21453 1/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL11657906 0.81 IDO1 (0.50) IDO1MAPTALDH1A1SMN1; SMN2KMT2A
SCHEMBL11359685 0.76 EPHX1 (0.51) SIGMAR1KCNH2L3MBTL1
SCHEMBL10930316 0.76 IDO1 (0.59) IDO1PTPRGPTPRCMAPTSMN1; SMN2
SCHEMBL11661930 0.75 IDO1 (0.50) IDO1MAPTALDH1A1SMN1; SMN2S1PR5
SCHEMBL11649453 0.74 IDO1 (0.57) IDO1PTPRGPTPRCMAPTALDH1A1
SCHEMBL11664604 0.73 SMN1; SMN2 (0.53) IDO1ALDH1A1SMN1; SMN2SIGMAR1TAAR1
SCHEMBL11657752 0.73 IDO1 (0.56) IDO1MAPTALDH1A1KMT2A
SCHEMBL11444326 0.72 IDO1 (0.62) IDO1PTPRGPTPRCMAPTPNMT
SCHEMBL11655628 0.71 TERT (0.41) MAPTSMN1; SMN2TSHRKMT2AMEN1
SCHEMBL30791545 0.71 EPHX2 (0.61) KDM4EALDH1A1SMN1; SMN2TSHRKMT2A

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
US-4112116-A Certain cyclopropane thiolcarboxylates and use thereof as miticides STAUFFER CHEMICAL COMPANY (US) 1978-09-05 US claimed
US-4112116-A Certain cyclopropane thiolcarboxylates and use thereof as miticides STAUFFER CHEMICAL COMPANY (US) 1978-09-05 US disclosed