SCHEMBL30354557

SCHEMBL30354557

CCCc1cccc(C(=O)O)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.61
MRGPRX4 Q96LA9 4/20 0.55
TP53 P04637 2/20 0.55
PKM P14618 2/20 0.55
NFKB1 P19838 2/20 0.55
NFKB2 Q00653 2/20 0.55
RELA Q04206 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
KAT6A Q92794 1/20 0.55
KMT2A Q03164 1/20 0.53
RAB9A P51151 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
HTT P42858 1/20 0.51
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
HIF1A Q16665 1/20 0.50
ANPEP P15144 1/20 0.50
ENPEP Q07075 1/20 0.50

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
SCHEMBL991080 1.00 FOLH1 (0.61) FOLH1MRGPRX4TP53PKMNFKB1
SCHEMBL849666 0.90 BCL2 (0.59) FOLH1MRGPRX4
SCHEMBL3387825 0.89 FOLH1 (0.58) FOLH1MRGPRX4TP53PKMNFKB1
SCHEMBL31124111 0.89 FOLH1 (0.58) FOLH1MRGPRX4TP53PKMNFKB1
SCHEMBL371526 0.88 FOLH1 (0.70) FOLH1MRGPRX4KMT2ACYP2D6CYP2C9
SCHEMBL443913 0.87 RARB (0.58) FOLH1KMT2A
SCHEMBL11752450 0.86 KAT6A (0.52) FOLH1KAT6A
SCHEMBL15766204 0.86 RARB (0.59) KMT2A
SCHEMBL1876486 0.86 RARB (0.59) KMT2A
SCHEMBL15174619 0.86 RARB (0.59) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2785752-B1 INTERNAL ELECTRON DONOR FOR OLEFIN POLYMERIZATION CATALYSTS, METHOD OF MAKING AND USING THE SAME BRASKEM AMERICA INC (US) 2023-05-31 EP claimed
CN-112759672-B Solid catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2023-04-11 CN claimed