SCHEMBL9843253

SCHEMBL9843253

C=C(C)C(=O)OC(C)Oc1ccccc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
TSHR P16473 2/20 0.39
TP53 P04637 1/20 0.39
CA12 O43570 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
ELANE P08246 1/20 0.36
KMT2A Q03164 3/20 0.35
IRAK4 Q9NWZ3 1/20 0.35
AR P10275 2/20 0.34
MAPT P10636 4/20 0.34
NPSR1 Q6W5P4 2/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL10764874 0.90 KMT2A (0.42) TSHRELANEKMT2AIRAK4MAPT
SCHEMBL649096 0.84 HPGD (0.42) TSHRELANEKMT2AIRAK4KDM4E
SCHEMBL10792054 0.83 ALDH1A1 (0.45) ELANEKMT2AMAPTLMNAALDH1A1
SCHEMBL27862420 0.83 CYP1A2 (0.39) TSHRELANEKMT2AIRAK4LMNA
SCHEMBL7524241 0.83 TSHR (0.40) TSHRELANEKMT2AIRAK4AR
SCHEMBL4649149 0.81 ATM (0.40) TSHRELANEKMT2AIRAK4KDM4E
SCHEMBL553944 0.81 ALDH1A1 (0.37) TSHRTP53ELANEKMT2AIRAK4
SCHEMBL27676257 0.81 ALDH1A1 (0.43) TSHRKMT2AKDM4EMAPK1RAB9A
SCHEMBL7524385 0.81 LMNA (0.41) KMT2AMAPTKDM4EMAPK1TDP1
SCHEMBL513071 0.81 CA1 (0.36) CA1CA2TSHRTP53CA12

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
EP-0412570-A2 Light- and heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1991-02-13 EP disclosed