SCHEMBL9226239

SCHEMBL9226239

CC1=CCC(C)=C1C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 4/20 0.32
MAPK1 P28482 1/20 0.31
TSHR P16473 2/20 0.30
ALDH1A1 P00352 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
SCHEMBL12814413 0.72 KCNN4 (0.34) KCNN4MAPK1TSHRALDH1A1
SCHEMBL9232333 0.69 TAAR1 (0.34) KCNN4MAPK1TSHRALDH1A1
Hydrochloric Acid SCHEMBL16459111 0.68 KCNN4 (0.31) KCNN4
SCHEMBL12814634 0.64 KCNN4 (0.32) KCNN4MAPK1TSHRALDH1A1
SCHEMBL230628 0.64 KCNN4 (0.53) KCNN4MAPK1TSHRALDH1A1
SCHEMBL12814992 0.63 ESR1 (0.39) KCNN4MAPK1ALDH1A1
SCHEMBL8671538 0.61 TSHR (0.57) KCNN4MAPK1TSHRALDH1A1
SCHEMBL14276997 0.61 TSHR (0.57) KCNN4MAPK1TSHRALDH1A1
SCHEMBL9632111 0.61 TSHR (0.57) KCNN4MAPK1TSHRALDH1A1
SCHEMBL12814963 0.61 KCNN4 (0.32) KCNN4MAPK1TSHRALDH1A1

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-0420134-B1 Process for producing styrene polymers IDEMITSU KOSAN CO (JP) 1996-02-07 EP claimed