SCHEMBL2750665

SCHEMBL2750665

CCCCCCCCCCCCc1ccc(C=Cc2cccc(C=Cc3ccc(CCCCCCCCCCCC)cc3)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.50
ADRA2A P08913 2/20 0.50
ADORA3 P0DMS8 2/20 0.50
TACR2 P21452 2/20 0.50
SLC6A2 P23975 2/20 0.50
SLC6A4 P31645 2/20 0.50
SLC6A3 Q01959 2/20 0.50
CYP3A4 P08684 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
SHBG P04278 1/20 0.50
TP53 P04637 1/20 0.50
HSPD1 P10809 1/20 0.50
ADRB3 P13945 1/20 0.50
HTR2C P28335 1/20 0.50
HSPE1 P61604 1/20 0.50
HIF1A Q16665 1/20 0.50
TST Q16762 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL7537271 0.89 HTR2A (0.54) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL7537266 0.89 HTR2A (0.54) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL7539291 0.87 CYSLTR2 (0.53) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL7539299 0.87 CYSLTR2 (0.53) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL7537284 0.85 LPL (0.51) LPLLIPG
SCHEMBL7539419 0.85 LPL (0.51) LPLLIPG
SCHEMBL7539412 0.85 LPL (0.51) LPLLIPG
SCHEMBL7537286 0.85 LPL (0.51) LPLLIPG
SCHEMBL3474192 0.84 HSD17B10 (0.59) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL3474194 0.84 HSD17B10 (0.59) ESR1ADRA2AADORA3TACR2SLC6A2

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-8178641-B2 Amino group-containing conjugated diene polymer and method for producing the same, and block copolymer and method for producing the same JSR CORPORATION (JP) 2012-05-15 US disclosed
US-20100267918-A1 AMINO GROUP-CONTAINING CONJUGATED DIENE POLYMER AND METHOD FOR PRODUCING THE SAME, AND BLOCK COPOLYMER AND METHOD FOR PRODUCING THE SAME JSR CORPORATION (JP) 2010-10-21 US disclosed