SCHEMBL14641668

SCHEMBL14641668

Cc1ccccc1CBC(C)(C)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 2/20 0.38
▸ PTGS1 P23219 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ KMT2A Q03164 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ CYP2A13 Q16696 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ CTBP2 P56545 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ CYP11B1 P15538 1/20 0.34
▸ CYP11B2 P19099 1/20 0.34
▸ DAO P14920 1/20 0.33
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ TK1 P04183 1/20 0.33
▸ KCNN4 O15554 1/20 0.33
▸ KDM4E B2RXH2 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
SCHEMBL10080116 0.81 TAAR1 (0.35) TAAR1PTGS1PTGS2KMT2AALDH1A1
SCHEMBL15314683 0.76 TAAR1 (0.40) TAAR1ALDH1A1LMNAESR1ESR2
SCHEMBL20344216 0.74 MEN1 (0.42) TAAR1KMT2AALDH1A1LMNAACHE
SCHEMBL14489004 0.71 TAAR1 (0.43) TAAR1KMT2AALDH1A1ESR1ESR2
SCHEMBL15976571 0.69 TAAR1 (0.38) TAAR1MAPK1KCNN4
SCHEMBL18265910 0.69 SMN1; SMN2 (0.39) TAAR1KMT2AALDH1A1LMNACYP11B1
SCHEMBL9284149 0.69 TAAR1 (0.48) TAAR1PTGS1PTGS2KMT2AALDH1A1
SCHEMBL275403 0.68 TAAR1 (0.43) TAAR1PTGS1PTGS2KMT2AALDH1A1
SCHEMBL6546943 0.68 TAAR1 (0.48) TAAR1PTGS1PTGS2ALDH1A1LMNA
SCHEMBL3217545 0.68 TAAR1 (0.39) TAAR1PTGS1PTGS2KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1657286-B1 Radiation curable ink jet ink, comprising a polymerisation initiation sensitising dye FUJIFILM CORP (JP) 2018-07-04 — — EP disclosed
EP-1832633-B1 Ink-jet recording ink set and ink-jet recording method FUJIFILM CORP (JP) 2016-11-30 — — EP disclosed
EP-1905610-B1 Ink jet recording method and device FUJIFILM CORP (JP) 2013-10-16 — — EP disclosed
EP-1975160-B1 Polymerizable compound, polymer, ink composition, printed articles and inkjet recording method FUJIFILM CORP (JP) 2013-01-16 — — EP disclosed
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