SCHEMBL4942228

SCHEMBL4942228

CCCCCCC(C)c1ccccc1O.CCCCCCCCCCC(C)c1ccccc1O

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.63
GABRA1 P14867 1/20 0.48
GABRB2 P47870 1/20 0.48
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
NAAA Q02083 1/20 0.41
CSNK1E P49674 1/20 0.41
POLB P06746 1/20 0.40
GPR84 Q9NQS5 1/20 0.40
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
SOAT1 P35610 1/20 0.39
PPARG P37231 2/20 0.38

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
SCHEMBL982149 1.00 TSHR (0.63) TSHRGABRA1GABRB2ALDH1A1MEN1
SCHEMBL9804614 1.00 TSHR (0.63) TSHRGABRA1GABRB2ALDH1A1MEN1
SCHEMBL10894979 1.00 TSHR (0.63) TSHRGABRA1GABRB2ALDH1A1MEN1
SCHEMBL983826 1.00 TSHR (0.63) TSHRGABRA1GABRB2ALDH1A1MEN1
SCHEMBL789269 1.00 TSHR (0.63) TSHRGABRA1GABRB2ALDH1A1MEN1
SCHEMBL983629 1.00 TSHR (0.63) TSHRGABRA1GABRB2ALDH1A1MEN1
SCHEMBL10804165 1.00 TSHR (0.63) TSHRGABRA1GABRB2ALDH1A1MEN1
SCHEMBL11779391 1.00 TSHR (0.63) TSHRGABRA1GABRB2ALDH1A1MEN1
SCHEMBL984105 1.00 TSHR (0.63) TSHRGABRA1GABRB2ALDH1A1MEN1
SCHEMBL1837139 1.00 TSHR (0.63) TSHRGABRA1GABRB2ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008036454-A1 POLY (ARYLENE ETHER) COPOLYMER SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-03-27 WO claimed
US-20080076884-A1 POLY(ARYLENE ETHER) COMPOSITION AND METHOD CITIBANK, N.A., AS COLLATERAL AGENT 2008-03-27 US claimed
US-20080085989-A1 POLY(ARYLENE ETHER) COPOLYMER CITIBANK, N.A., AS COLLATERAL AGENT 2008-04-10 US disclosed
US-20080076885-A1 POLY(ARYLENE ETHER) COMPOSITION AND METHOD CITIBANK, N.A., AS COLLATERAL AGENT 2008-03-27 US disclosed
WO-2008036454-A1 POLY (ARYLENE ETHER) COPOLYMER SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-03-27 WO disclosed
US-20080076884-A1 POLY(ARYLENE ETHER) COMPOSITION AND METHOD CITIBANK, N.A., AS COLLATERAL AGENT 2008-03-27 US disclosed