SCHEMBL20445720

SCHEMBL20445720

Cc1cc(C)c(C(=O)P(=O)(O)c2ccccc2)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA5A P35218 1/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CYP1A2 P05177 1/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 2/20 0.37
CFTR P13569 1/20 0.37
SORT1 Q99523 1/20 0.37
TSHR P16473 3/20 0.36
FKBP5 Q13451 1/20 0.36
ALOX15 P16050 1/20 0.35
USP2 O75604 1/20 0.35
ESR1 P03372 1/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL1732259 0.84 KMT2A (0.41) CA2CA4CA5AKMT2ANPC1
SCHEMBL1186385 0.84 KMT2A (0.41) CA2CA4CA5AKMT2ANPC1
SCHEMBL29634650 0.84 KMT2A (0.41) CA2CA4CA5AKMT2ANPC1
SCHEMBL10527135 0.83 NFE2L2 (0.48) KMT2ANPC1RAB9AALDH1A1MEN1
SCHEMBL3381277 0.82 HPGD (0.49) CA2CA4CA5AKMT2ANPC1
Lithium Ion SCHEMBL31534099 0.80 KMT2A (0.39) CA2CA4CA5AKMT2ANPC1
SCHEMBL14342955 0.79 POLB (0.38) CA2CA4CA5AKMT2ANPC1
SCHEMBL1714766 0.78 CA2 (0.39) CA2CA4CA5AKMT2ANPC1
SCHEMBL3886065 0.77 CA2 (0.38) CA2CA4CA5AKMT2ANPC1
SCHEMBL117062 0.76 CFTR (0.41) CA2CA4CA5AKMT2ANPC1

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-3357948-B1 POLYTHIOL COMPOSITION FOR PLASTIC LENS SK PUCORE CO LTD (KR) 2025-04-02 EP disclosed
US-10669367-B2 Polythiol composition for plastic lens SKC CO., LTD. (KR) 2020-06-02 US disclosed
US-20180223031-A1 POLYTHIOL COMPOSITION FOR PLASTIC LENS SKC CO., LTD. (KR) 2018-08-09 US disclosed
EP-3357948-A1 POLYTHIOL COMPOSITION FOR PLASTIC LENS SKC Co., Ltd. (KR) 2018-08-08 EP disclosed