SCHEMBL7187984

SCHEMBL7187984

C=C(CCCC)c1ccc(O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 8/20 0.60
ESR1 P03372 8/20 0.58
ESR2 Q92731 3/20 0.58
LMNA P02545 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2D6 P10635 2/20 0.46
TSHR P16473 2/20 0.46
MAPK1 P28482 2/20 0.46
CYP2C19 P33261 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NR1H2 P55055 1/20 0.46
RNASEL Q05823 1/20 0.46
HSD17B10 Q99714 3/20 0.45
ADRA2A P08913 3/20 0.45
ADORA3 P0DMS8 3/20 0.45
TACR2 P21452 3/20 0.45
SLC6A2 P23975 3/20 0.45
SLC6A4 P31645 3/20 0.45
SLC6A3 Q01959 3/20 0.45
MAPT P10636 2/20 0.45

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
SCHEMBL28209780 0.92 HSD17B3 (0.62) HSD17B3ESR1ESR2LMNAHSD17B10
SCHEMBL27944125 0.92 HSD17B3 (0.62) HSD17B3ESR1ESR2LMNAHSD17B10
SCHEMBL9627145 0.87 HSD17B3 (0.57) HSD17B3ESR1ESR2LMNACYP1A2
SCHEMBL7193415 0.83 ALDH1A1 (0.44) HSD17B3ESR1ESR2LMNASMN1; SMN2
SCHEMBL12075203 0.82 HSD17B3 (0.59) HSD17B3ESR1ESR2LMNACYP1A2
SCHEMBL2015788 0.82 HTR7 (0.61) PTGS1PTGS2
SCHEMBL10414514 0.82 HDAC3 (0.45) HSD17B3ESR1ESR2CYP1A2CYP2D6
SCHEMBL11696345 0.82 LMNA (0.47) HSD17B3ESR1ESR2LMNACYP1A2
SCHEMBL2011999 0.82 MAOA (0.48) HSD17B3ESR1ESR2LMNASMN1; SMN2
SCHEMBL10413952 0.82 ALDH1A1 (0.45) HSD17B3ESR1ESR2SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-58079920-A None JP disclosed
JP-58079919-A None JP disclosed
US-20030075715-A1 Thin film transistor NEC CORPORATION (JP) 2003-04-24 US disclosed
EP-0202458-B1 CROSS-LINKED POLYALKENYL PHENOL BASED PHOTORESIST COMPOSITIONS International Business Machines Corporation (US) 1992-03-25 EP disclosed
US-4810814-A Preparation of cyanoalkylphenols THE DOW CHEMICAL COMPANY (US) 1989-03-07 US disclosed
EP-0202458-A2 Cross-linked polyalkenyl phenol based photoresist compositions International Business Machines Corporation (US) 1986-11-26 EP disclosed
JP-S5879920-A INHIBITOR AGAINST BLOOD PLATELET AGGREGATION KANEGAFUCHI CHEM IND CO LTD 1983-05-13 JP disclosed
JP-S5879919-A ANTIPHLOGISTIC, ANALGESIC AND ANTIPYRETIC KANEGAFUCHI CHEM IND CO LTD 1983-05-13 JP disclosed
US-4221700-A POLY(ALKYLATED ALKENYLPHENOL); POLYESTERS OF ALKYLTHIOALKANOIC ACIDS OR ORGANIC PHOSPHITE MARUZEN OIL CO., LTD. (JP) 1980-09-09 US disclosed
JP-S05879919-A 0001-01-01 JP disclosed