SCHEMBL9162282

SCHEMBL9162282

CCCCOCCC=COC=CCCOCCCC

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
CYP3A4 P08684 1/20 0.39
MEN1 O00255 1/20 0.35
THRB P10828 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
ATM Q13315 1/20 0.31

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
SCHEMBL3939351 0.91 MEN1 (0.47) TSHRMEN1THRBHTTKMT2A
SCHEMBL21174467 0.86 HSD17B10 (0.31)
SCHEMBL6658271 0.84 TSHR (0.43) TSHRCYP3A4MEN1THRBHTT
SCHEMBL6658273 0.84 TSHR (0.43) TSHRCYP3A4MEN1THRBHTT
SCHEMBL20168132 0.82 TSHR (0.34) TSHRCYP3A4MEN1THRBHTT
SCHEMBL8374766 0.79 TSHR (0.46) TSHRCYP3A4MEN1THRBHTT
SCHEMBL283330 0.79 TSHR (0.46) TSHRCYP3A4MEN1THRBHTT
SCHEMBL15870696 0.79 TSHR (0.46) TSHRCYP3A4MEN1THRBHTT
SCHEMBL31589025 0.79 TSHR (0.46) TSHRCYP3A4MEN1THRBHTT
SCHEMBL3153402 0.78 ALDH1A1 (0.38) TSHR

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
EP-3514133-A1 METHOD FOR REMOVING OR COLLECTING 2-ALKOXYETHANOL, AND METHOD FOR PRODUCING (2-ALKOXYETHYL) VINYL ETHER Maruzen Petrochemical Co., Ltd. (JP) 2019-07-24 EP disclosed
EP-0272215-B1 Process for obtaining images CIBA GEIGY AG (CH) 1995-03-08 EP disclosed
US-4857437-A Process for the formation of an image CIBA-GEIGY CORPORATION (US) 1989-08-15 US disclosed
US-4777214-A SOLVENT RESISTANCE, HEAT RESISTANCE, DIELECTRICS RAYCHEM CORPORATION (US) 1988-10-11 US disclosed
EP-0272215-A2 Process for obtaining images CIBA-GEIGY AG (CH) 1988-06-22 EP disclosed
EP-0192397-A1 Blends of poly(arylene ether ketones) and tetrafluoroethylene copolymers RAYCHEM CORPORATION (a Delaware corporation) (US) 1986-08-27 EP disclosed