SCHEMBL11856483

SCHEMBL11856483

C=Cc1cccc(C(=O)c2cccc(C=C)c2C)c1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 6/20 0.35
TSHR P16473 2/20 0.35
TP53 P04637 2/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC22A8 Q8TCC7 3/20 0.35
SLC22A6 Q4U2R8 2/20 0.35
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TLR2 O60603 1/20 0.33
TLR1 Q15399 1/20 0.33
TLR6 Q9Y2C9 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
POLB P06746 2/20 0.33

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
SCHEMBL5082542 0.86 TSHR (0.47) CYP3A4CYP2C9KMT2AALDH1A1TSHR
SCHEMBL10974422 0.86 ESR2 (0.36) ESR2CYP3A4KMT2AALDH1A1TSHR
SCHEMBL5189064 0.85 ALDH1A1 (0.44) ALDH1A1TSHRGAAMAPTSMN1; SMN2
SCHEMBL28836772 0.85 ALDH1A1 (0.38) ESR2CYP3A4CYP2C9KMT2AALDH1A1
SCHEMBL28143156 0.85 AKT1 (0.39) ESR2CYP3A4KMT2AALDH1A1TSHR
SCHEMBL16958924 0.82 ALDH1A1 (0.48) KMT2AALDH1A1TSHRMAPTSMN1; SMN2
SCHEMBL30280797 0.82 ALDH1A1 (0.48) KMT2AALDH1A1TSHRMAPTSMN1; SMN2
SCHEMBL28825380 0.82 HSP90AB1 (0.36) ESR2CYP3A4KMT2AALDH1A1TSHR
SCHEMBL3861816 0.82 ALDH1A1 (0.35) ESR2ALDH1A1TP53TDP1
SCHEMBL5047783 0.80 ALDH1A1 (0.35) ESR2CYP3A4KMT2AALDH1A1TSHR

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
US-3932573-A Process for producing glass fiber reinforced injection molding compounds ETHYL CORPORATION (US) 1976-01-13 US disclosed