SCHEMBL8970200

SCHEMBL8970200

CCOC(=O)C1CSCC1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.42
PTPN1 P18031 1/20 0.42
PPP1CC P36873 1/20 0.42
ALDH1A1 P00352 2/20 0.36
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA9 Q16790 2/20 0.36
MAPT P10636 2/20 0.36
PKM P14618 1/20 0.36
TSHR P16473 1/20 0.34

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
SCHEMBL8970499 0.85 PPM1B (0.45) PPM1BPTPN1PPP1CCALDH1A1
SCHEMBL19342535 0.83 SOAT1 (0.35) PPM1BPTPN1PPP1CCALDH1A1CA12
SCHEMBL8969294 0.82 ALDH1A1 (0.41) PPM1BPTPN1PPP1CCALDH1A1TSHR
SCHEMBL8970154 0.81 PPARG (0.43) ALDH1A1TSHR
SCHEMBL8970421 0.81 CYP1A2 (0.36) PPM1BPTPN1PPP1CCALDH1A1CA12
SCHEMBL8971023 0.80 RAB9A (0.39) ALDH1A1TSHR
SCHEMBL9033901 0.80 ALDH1A1 (0.39) PPM1BPTPN1PPP1CCALDH1A1CA12
SCHEMBL9033905 0.80 ALDH1A1 (0.39) PPM1BPTPN1PPP1CCALDH1A1CA12
SCHEMBL9033895 0.80 ALDH1A1 (0.39) PPM1BPTPN1PPP1CCALDH1A1CA12
SCHEMBL8969975 0.80 PPARG (0.45) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0376294-B1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI LTD (JP) 1996-03-13 EP disclosed
US-5370821-A Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-12-06 US disclosed
US-5269965-A Optically active compounds, liquid crystal compositions comprising said compounds and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES (JP) 1993-12-14 US disclosed
EP-0376294-A1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI, LTD. (JP) 1990-07-04 EP disclosed