SCHEMBL20164060

SCHEMBL20164060

CCCCCCN(C(=O)c1ccccc1Cl)c1ccc(F)c([Ti](c2c(F)ccc(N(CCCCCC)C(=O)c3ccccc3Cl)c2F)(C2C=CC=C2)C2C=CC=C2)c1F

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.39
ALDH1A1 P00352 2/20 0.38
S1PR1 P21453 7/20 0.37
S1PR3 Q99500 4/20 0.36
NPC1 O15118 1/20 0.35
JAK2 O60674 1/20 0.35
RAB9A P51151 1/20 0.35
PAX8 Q06710 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
S1PR4 O95977 1/20 0.33
S1PR5 Q9H228 1/20 0.33
THRB P10828 1/20 0.32

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
SCHEMBL29479959 0.87 ALDH1A1 (0.38) TP53ALDH1A1S1PR1NPC1JAK2
SCHEMBL29479974 0.86 S1PR1 (0.42) TP53ALDH1A1S1PR1NPC1JAK2
SCHEMBL29479972 0.84 MLYCD (0.38) TP53ALDH1A1S1PR1NPC1JAK2
SCHEMBL20291434 0.83 S1PR1 (0.41) TP53ALDH1A1S1PR1HPGD
SCHEMBL29479994 0.82 S1PR1 (0.40) TP53ALDH1A1S1PR1HPGDMAPT
SCHEMBL29479995 0.82 ALDH1A1 (0.35) TP53ALDH1A1S1PR1NPC1JAK2
SCHEMBL19970863 0.82 POLB (0.40) TP53RAB9ALMNAHPGDMAPT
SCHEMBL483228 0.81 TP53 (0.36) TP53ALDH1A1S1PR1S1PR3NPC1
SCHEMBL27565956 0.81 TP53 (0.44) TP53ALDH1A1S1PR1S1PR3NPC1
SCHEMBL20164078 0.80 ALDH1A1 (0.33) TP53ALDH1A1NPC1JAK2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113383273-B Photosensitive resin composition, pattern forming method, cured film, laminate, and device 富士胶片株式会社 2023-11-14 CN disclosed
CN-114402256-A Organic film, method for producing same, composition, laminate, and semiconductor device 富士胶片株式会社 2022-04-26 CN disclosed
US-20180141268-A1 Method for Making an Object PHOTOCENTRIC LIMITED (GB) 2018-05-24 US disclosed