SCHEMBL29080969

SCHEMBL29080969

CC(C)c1ccc(OC(O)CO)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
RAB9A P51151 4/20 0.41
KMT2A Q03164 5/20 0.40
ABCB11 O95342 1/20 0.40
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
FKBP1A P62942 1/20 0.39
MEN1 O00255 3/20 0.39
IDO1 P14902 2/20 0.38
NPC1 O15118 2/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
MAPK1 P28482 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
SCHEMBL183507 0.85 TSHR (0.33) KMT2AABCB11POLBMAPK1
SCHEMBL9355490 0.82 SMN1; SMN2 (0.45) SMN1; SMN2RAB9AKMT2AABCB11RXRA
SCHEMBL109613 0.79 TDP1 (0.42) SMN1; SMN2RAB9AKMT2AMEN1POLB
SCHEMBL11142916 0.79 KMT2A (0.43) SMN1; SMN2RAB9AKMT2ARXRARXRB
Hydrochloric Acid SCHEMBL9794570 0.78 TDP1 (0.41) SMN1; SMN2RAB9AKMT2AMEN1NPC1
Water SCHEMBL9794578 0.78 TDP1 (0.41) SMN1; SMN2RAB9AKMT2AMEN1POLB
SCHEMBL8917076 0.77 ESR2 (0.44) RAB9AKMT2AMEN1NPC1KDM4E
Hydrochloric Acid SCHEMBL9794561 0.76 TDP1 (0.40) SMN1; SMN2RAB9AKMT2AMEN1NPC1
SCHEMBL16623977 0.75 POLB (0.39) SMN1; SMN2RAB9AKMT2ARXRARXRB
SCHEMBL25083791 0.74 SMN1; SMN2 (0.46) SMN1; SMN2RAB9AKMT2AABCB11RXRA

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
CN-112969682-B Compound, resin precursor, cured product, optical element, and optical system 株式会社尼康 2023-09-26 CN disclosed