SCHEMBL31353024

SCHEMBL31353024

Cc1ccc(/C=C/C=C/C(=O)c2ccccc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.78
ALDH1A1 P00352 5/20 0.78
CYP3A4 P08684 3/20 0.78
HPGD P15428 3/20 0.78
CYP1B1 Q16678 2/20 0.68
MAOB P27338 6/20 0.58
LMNA P02545 4/20 0.58
BCHE P06276 2/20 0.58
PLIN1 O60240 1/20 0.58
TNFRSF1A P19438 1/20 0.58
ACHE P22303 1/20 0.58
RECQL P46063 1/20 0.58
PLIN5 Q00G26 1/20 0.58
ABHD5 Q8WTS1 1/20 0.58
RAB9A P51151 3/20 0.57
MAOA P21397 3/20 0.57
POLB P06746 2/20 0.57
NFKB1 P19838 3/20 0.56
NFKB2 Q00653 3/20 0.56
RELA Q04206 3/20 0.56

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
SCHEMBL31353017 0.93 CYP1B1 (0.78) MAPTALDH1A1CYP3A4HPGDCYP1B1
SCHEMBL31353016 0.93 CYP1B1 (0.78) MAPTALDH1A1CYP3A4HPGDCYP1B1
SCHEMBL5753797 0.88 MAPT (1.00) MAPTALDH1A1CYP3A4HPGDCYP1B1
SCHEMBL6200952 0.88 MAPT (1.00) MAPTALDH1A1CYP3A4HPGDCYP1B1
SCHEMBL76030 0.88 MAPT (1.00) MAPTALDH1A1CYP3A4HPGDCYP1B1
SCHEMBL1614246 0.88 MAOB (0.74) MAPTALDH1A1CYP3A4HPGDCYP1B1
SCHEMBL1614248 0.88 MAOB (0.74) MAPTALDH1A1CYP3A4HPGDCYP1B1
SCHEMBL1614247 0.88 MAOB (0.74) MAPTALDH1A1CYP3A4HPGDCYP1B1
Bromide SCHEMBL11333938 0.86 MAOB (0.71) MAPTALDH1A1CYP3A4HPGDCYP1B1
Bromide SCHEMBL11319714 0.86 MAOB (0.71) MAPTALDH1A1CYP3A4HPGDCYP1B1

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-119390715-A Method for catalyzing chiral boron addition reaction of alpha, beta, gamma, delta-unsaturated ketone by nano composite microsphere loaded copper material 湖北工程学院 2025-02-07 CN disclosed