SCHEMBL9058773

SCHEMBL9058773

C=CCCCC(=O)c1ccccc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.50
MAPT P10636 5/20 0.46
KDM4E B2RXH2 5/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
RAB9A P51151 2/20 0.46
KCNH2 Q12809 1/20 0.46
HPGD P15428 4/20 0.42
ALDH1A1 P00352 3/20 0.42
CA1 P00915 2/20 0.42
CA9 Q16790 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CA12 O43570 1/20 0.42
CA2 P00918 1/20 0.42
HMGB1 P09429 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA7 P43166 1/20 0.42
NAPRT Q6XQN6 1/20 0.42
CA14 Q9ULX7 1/20 0.42

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
SCHEMBL1055192 0.81 CTNNB1 (0.49) MEN1KMT2AALDH1A1SMN1; SMN2CTNNB1
SCHEMBL16313719 0.81 MAPT (0.44) MAPTKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL8672674 0.81 CYP19A1 (0.59) CYP19A1MAPTKDM4EMEN1KMT2A
SCHEMBL8670350 0.81 CYP19A1 (0.59) CYP19A1MAPTKDM4EMEN1KMT2A
SCHEMBL8519711 0.81 CYP19A1 (0.59) CYP19A1MAPTKDM4EMEN1KMT2A
SCHEMBL28715216 0.81 EP300 (0.53) CYP19A1MAPTMEN1KMT2AHPGD
SCHEMBL6746832 0.80 CYP19A1 (0.54) CYP19A1MAPTKDM4EMEN1KMT2A
SCHEMBL31211720 0.79 CYP19A1 (0.66) CYP19A1MAPTKDM4EMEN1KMT2A
SCHEMBL4446464 0.79 GPR52 (0.48) KDM4EMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL3803604 0.78 KDM4E (0.48) CYP19A1MAPTKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8262868-A None JP disclosed
EP-4727948-A1 ANTIMALARIAL AGENTS Merck Sharp & Dohme LLC (US) 2026-04-22 EP disclosed
WO-2024254795-A1 ANTIMALARIA AGENTS MERCK SHARP & DOHME LLC (US) 2024-12-19 WO disclosed
WO-2024258769-A1 ANTIMALARIAL AGENTS MERCK SHARP & DOHME LLC (US) 2024-12-19 WO disclosed
JP-H08262868-A DEVELOPING ROLL AND DEVELOPING DEVICE TOKAI RUBBER IND LTD 1996-10-11 JP disclosed