SCHEMBL10356406

SCHEMBL10356406

CCC(O)(c1cccc(C(F)(F)F)c1)c1ccc(O)cc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 3/20 0.40
▸ ESR2 Q92731 3/20 0.40
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ MAPT P10636 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HTT P42858 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ POLB P06746 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ HDAC3 O15379 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ IDO1 P14902 2/20 0.36
▸ NOS3 P29474 2/20 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 0.87 KIF11 (0.42) ESR1ESR2CYP3A4CYP2D6
SCHEMBL10356346 0.83 ESR1 (0.39) ESR1ESR2CYP3A4ALDH1A1HTT
SCHEMBL10356950 0.83 TSHR (0.41) ESR1ESR2
SCHEMBL10740804 0.82 ESR1 (0.47) ESR1ESR2MAPTALDH1A1MEN1
SCHEMBL10356748 0.79 ESR1 (0.36) ESR1ESR2TRPV1IDO1NOS3
SCHEMBL10356747 0.78 ESR1 (0.39) ESR1ESR2CYP3A4CYP2D6MAPT
Flumecinol SCHEMBL667363 0.77 ALDH1A1 (0.45) CYP3A4CYP2D6MAPTALDH1A1MEN1
SCHEMBL10356413 0.75 ESR1 (0.42) ESR1ESR2MAPTMEN1KMT2A
Propane SCHEMBL3966641 0.72 IDO1 (0.47) ESR1ESR2CYP3A4MAPTALDH1A1
SCHEMBL10356407 0.71 TTR (0.43) CYP3A4MAPTALDH1A1MEN1KMT2A

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 7 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-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
EP-0116234-B1 CARBAMYLOXYBENZHYDROLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Richter Gedeon Vegyészeti Gyár R.T. (HU) 1986-03-26 — — EP disclosed
US-4564630-A ANTILIPEMIC AGENTS RICHTER GEDEON VEGYESZETI GYAR RT (HU) 1986-01-14 — — US disclosed
US-4510338-A TREATMENT OF ACUTE ETHANOLIC INTOXICATION/- RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1985-04-09 — — US disclosed
EP-0116234-A1 Carbamyloxybenzhydrole derivatives, process for their preparation and pharmaceutical compositions containing them Richter Gedeon Vegyészeti Gyár R.T. (HU) 1984-08-22 — — EP 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
Send feedback