SCHEMBL19309267

SCHEMBL19309267

C=C(C=CC)CCCc1ccc(O)c(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 2/20 0.54
▸ TSHR P16473 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ MTNR1A P48039 1/20 0.53
▸ MTNR1B P49286 1/20 0.53
▸ LMNA P02545 1/20 0.52
▸ GLA P06280 1/20 0.52
▸ ALOX5 P09917 4/20 0.51
▸ CYP3A4 P08684 3/20 0.51
▸ PTPN1 P18031 2/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ AR P10275 1/20 0.51
▸ PTGS1 P23219 1/20 0.51
▸ TRPM8 Q7Z2W7 1/20 0.51
▸ OR51E2 Q9H255 1/20 0.51
▸ CALM1 P0DP23 1/20 0.51
▸ HTR1A P08908 3/20 0.50
▸ CYP1A2 P05177 2/20 0.50
▸ CYP2C8 P10632 2/20 0.50
▸ CYP2C9 P11712 2/20 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
SCHEMBL19774465 0.80 MTNR1A (0.62) TAAR1TSHRMAPK1MTNR1AMTNR1B
SCHEMBL12300604 0.79 HTR1A (0.67) TAAR1TSHRMAPK1MTNR1AMTNR1B
SCHEMBL5072123 0.79 TAAR1 (0.76) TAAR1TSHRMAPK1MTNR1AMTNR1B
SCHEMBL9281549 0.79 TAAR1 (0.76) TAAR1TSHRMAPK1MTNR1AMTNR1B
SCHEMBL10907682 0.78 ALOX5 (0.65) TAAR1TSHRMAPK1MTNR1AMTNR1B
SCHEMBL10738270 0.77 ALOX5 (0.75) TAAR1TSHRMAPK1MTNR1AMTNR1B
SCHEMBL12799389 0.76 LTA4H (0.77) ALOX5CYP3A4ALDH1A1HTR1ACYP1A2
SCHEMBL5723843 0.76 ALOX5 (0.66) TAAR1TSHRMAPK1MTNR1AMTNR1B
SCHEMBL3175165 0.76 TSHR (0.67) TAAR1TSHRMAPK1MTNR1AMTNR1B
SCHEMBL27488164 0.76 MTNR1A (0.68) TAAR1TSHRMAPK1MTNR1AMTNR1B

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-9751979-B2 Copolycarbonate and composition containing the same LG CHEM, LTD. (KR) 2017-09-05 — — US disclosed
Send feedback