SCHEMBL31339959

SCHEMBL31339959

COC(=O)c1ccc2cc(C(=O)O)c(=O)n(-c3ccccc3)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
POLB P06746 1/20 0.46
LMNA P02545 2/20 0.46
KDM4E B2RXH2 2/20 0.46
FGFR1 P11362 1/20 0.45
MAPT P10636 2/20 0.44
PTPN11 Q06124 1/20 0.43
NOTUM Q6P988 1/20 0.43
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL30548972 0.80 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL31339884 0.77 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL19511677 0.75 ACSS2 (0.46) ALDH1A1KMT2ANOTUMNPC1
SCHEMBL31657609 0.73 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL3844231 0.72 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL4604283 0.72 FGFR1 (0.56) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL10974097 0.72 KDM4E (0.52) ALDH1A1SMN1; SMN2KMT2AKDM4ENOTUM
SCHEMBL30201534 0.72 FGFR1 (0.56) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL31339843 0.72 SLC16A3 (0.42) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL31339902 0.72 KDM4E (0.42) ALDH1A1MEN1KMT2APOLBLMNA

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-4501912-A1 NOVEL HETEROCYCLIC COMPOUND Shouyao Holdings (Beijing) Co., Ltd. (CN) 2025-02-05 EP disclosed