SCHEMBL22668118

SCHEMBL22668118

CC(C)C(C)(C)c1ccc(Bc2ccc(O)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 15/20 0.45
▸ ESR2 Q92731 15/20 0.45
▸ CYP3A4 P08684 3/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TYR P14679 1/20 0.45
▸ AR P10275 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A4 P31645 1/20 0.45
▸ HTR6 P50406 1/20 0.45
▸ ESRRG P62508 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.39
▸ SHBG P04278 1/20 0.38
▸ PDCD1 Q15116 1/20 0.35
▸ CD274 Q9NZQ7 1/20 0.35
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL1773215 0.88 ESR1 (0.56) ESR1ESR2CYP3A4LMNATYR
SCHEMBL13409808 0.73 ALOX15 (0.57) ESR1ESR2CYP3A4LMNATYR
SCHEMBL10708021 0.71 ESR1 (0.52) ESR1ESR2CYP3A4LMNATYR
SCHEMBL27896889 0.71 ESR1 (0.52) ESR1ESR2CYP3A4LMNATYR
SCHEMBL278255 0.70 ESR1 (0.56) ESR1ESR2CYP3A4LMNATYR
SCHEMBL8770754 0.69 ESR1 (0.50) ESR1ESR2CYP3A4LMNATYR
SCHEMBL28132199 0.69 ESR1 (0.54) ESR1ESR2CYP3A4LMNATYR
SCHEMBL24115139 0.68 ESR1 (0.48) ESR1ESR2CYP3A4LMNATYR
SCHEMBL7202909 0.68 ESR1 (0.48) ESR1ESR2CYP3A4LMNATYR
SCHEMBL19359671 0.68 ESR1 (0.42) ESR1ESR2CYP3A4LMNATYR

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-20200362107-A1 SULFONATED POLY(ARYLENE ETHER) MEMBRANES WITH HIGH MONOVALENT SALT REJECTION EVEN IN THE PRESENCE OF MIXED SALT FEEDS THAT CONTAIN MULTIVALENT SALTS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2020-11-19 — — US disclosed
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