SCHEMBL29618949

SCHEMBL29618949

C=Cc1ccc(C)c(C)c1C

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
TSHR P16473 1/20 0.31
TDP2 O95551 1/20 0.31
NSD2 O96028 1/20 0.31
HSP90AA1 P07900 1/20 0.31
PAX8 Q06710 1/20 0.31
METAP2 P50579 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TP53 P04637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL57999 1.00 MAPT (0.33) MAPTKDM4EMAPK1ALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL11018653 0.95 KDM4E (0.31) MAPTKDM4EMAPK1ALDH1A1
SCHEMBL11661670 0.89 ALDH1A1 (0.38) ALDH1A1TSHRMETAP2TP53TDP1
SCHEMBL31391761 0.89 ALDH1A1 (0.38) ALDH1A1TSHRMETAP2TP53TDP1
Water SCHEMBL20239032 0.86 ALDH1A1 (0.36) ALDH1A1TSHRMETAP2TP53TDP1
Methacrylic Acid SCHEMBL23013976 0.82 METAP2 (0.35) METAP2
SCHEMBL8676276 0.80 MAPT (0.39) MAPTKDM4EMAPK1ALDH1A1TSHR
SCHEMBL29434185 0.80 KDM4E (0.31) MAPTKDM4EMAPK1ALDH1A1
SCHEMBL158243 0.80 KDM4E (0.31) MAPTKDM4EMAPK1ALDH1A1
SCHEMBL23527759 0.80 CCR3 (0.34) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114643083-B Monolithic poly (chlorotrifluoroethylene) bipolar membrane containing metal phthalocyanine derivative hydrolysis catalyst and preparation method thereof 福建师范大学 2023-12-05 CN claimed
CN-114536915-B Alkali-resistant bipolar membrane with main chain fluorocarbon-ferrocene catalytic layer and preparation method thereof 福建师范大学 2023-05-23 CN claimed
CN-114643083-A Monolithic polytrifluorochloroethylene bipolar membrane containing metal phthalocyanine derivative water dissociation catalyst and preparation method thereof 福建师范大学 2022-06-21 CN claimed
CN-114536915-A Alkali-resistant bipolar membrane with main chain fluorocarbon-ferrocene catalyst layer and preparation method thereof 福建师范大学 2022-05-27 CN claimed
CN-114643083-B Monolithic poly (chlorotrifluoroethylene) bipolar membrane containing metal phthalocyanine derivative hydrolysis catalyst and preparation method thereof 福建师范大学 2023-12-05 CN disclosed
CN-114536915-B Alkali-resistant bipolar membrane with main chain fluorocarbon-ferrocene catalytic layer and preparation method thereof 福建师范大学 2023-05-23 CN disclosed
CN-114643083-A Monolithic polytrifluorochloroethylene bipolar membrane containing metal phthalocyanine derivative water dissociation catalyst and preparation method thereof 福建师范大学 2022-06-21 CN disclosed
CN-114536915-A Alkali-resistant bipolar membrane with main chain fluorocarbon-ferrocene catalyst layer and preparation method thereof 福建师范大学 2022-05-27 CN disclosed