SCHEMBL10356747

SCHEMBL10356747

CCC(O)(c1ccc(F)cc1)c1ccc(O)cc1O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 5/20 0.39
▸ ESR2 Q92731 3/20 0.38
▸ HTT P42858 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CYP3A4 P08684 3/20 0.37
▸ CYP2D6 P10635 2/20 0.37
▸ CYP2C9 P11712 2/20 0.37
▸ CYP2C19 P33261 2/20 0.37
▸ TYR P14679 5/20 0.37
▸ KMT2A Q03164 3/20 0.36
▸ AR P10275 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL10356402 0.88 KIF11 (0.42) ESR1ESR2CYP3A4CYP2D6AR
SCHEMBL10356413 0.84 ESR1 (0.42) ESR1ESR2HTTLMNASMN1; SMN2
SCHEMBL10356346 0.84 ESR1 (0.39) ESR1ESR2HTTLMNASMN1; SMN2
SCHEMBL10784555 0.81 ESR1 (0.52) ESR1ESR2HTTLMNASMN1; SMN2
SCHEMBL23003764 0.81 ALDH1A1 (0.41) ESR1ESR2HTTLMNASMN1; SMN2
SCHEMBL10356406 0.78 ESR1 (0.40) ESR1ESR2HTTSMN1; SMN2CYP3A4
SCHEMBL6935611 0.77 CYP3A4 (0.50) ESR1ESR2HTTLMNASMN1; SMN2
SCHEMBL27911913 0.75 AOC3 (0.42) ESR2HTTLMNASMN1; SMN2CYP3A4
SCHEMBL10356950 0.75 TSHR (0.41) ESR1ESR2ALOX5TSHR
SCHEMBL10356407 0.75 TTR (0.43) LMNACYP3A4KMT2AMEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0112587-B1 DERIVATIVES OF 4-(1-(PHENYL)-1-(HYDROXY)-PROP-1-YL)-RESORCINE, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1990-09-19 — — EP claimed
EP-0112587-A2 Derivatives of 4-(1-(phenyl)-1-(hydroxy)-prop-1-yl)-resorcine, process for their preparation and medicines containing these compounds RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1984-07-04 — — EP claimed
EP-0112587-B1 DERIVATIVES OF 4-(1-(PHENYL)-1-(HYDROXY)-PROP-1-YL)-RESORCINE, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1990-09-19 — — EP disclosed
US-4510338-A TREATMENT OF ACUTE ETHANOLIC INTOXICATION/- RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1985-04-09 — — US disclosed
EP-0112587-A2 Derivatives of 4-(1-(phenyl)-1-(hydroxy)-prop-1-yl)-resorcine, process for their preparation and medicines containing these compounds RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1984-07-04 — — EP disclosed
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