SCHEMBL30121995

SCHEMBL30121995

O=Cc1cc(Br)ccc1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.46
SRD5A2 P31213 2/20 0.43
MAPT P10636 4/20 0.43
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 2/20 0.43
NR4A1 P22736 1/20 0.42
TP53 P04637 1/20 0.42
SLC10A6 Q3KNW5 1/20 0.42
LMNA P02545 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
FLT1 P17948 2/20 0.41
FLT4 P35916 2/20 0.41
KDR P35968 2/20 0.41
MAPK1 P28482 1/20 0.41
POLB P06746 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40

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
SCHEMBL20446318 1.00 ERN1 (0.46) ERN1SRD5A2MAPTALDH1A1KMT2A
SCHEMBL30122183 0.81 AKR1C3 (0.43) ERN1SRD5A2MAPTALDH1A1KMT2A
SCHEMBL20446377 0.81 AKR1C3 (0.43) ERN1SRD5A2MAPTALDH1A1KMT2A
SCHEMBL20447479 0.81 NPC1 (0.48) ERN1MAPTALDH1A1KMT2ATP53
SCHEMBL29872272 0.81 NPC1 (0.48) ERN1MAPTALDH1A1KMT2ATP53
SCHEMBL8479014 0.79 CASP3 (0.51) ERN1MAPTALDH1A1KMT2ATP53
SCHEMBL12332975 0.78 TDP1 (0.51) SRD5A2MAPTALDH1A1KMT2ANR4A1
SCHEMBL3025807 0.78 KMT2A (0.61) SRD5A2MAPTALDH1A1KMT2ANR4A1
SCHEMBL1822194 0.78 NR4A1 (0.62) SRD5A2MAPTALDH1A1NR4A1SLC10A6
SCHEMBL1247945 0.78 NR4A1 (0.62) SRD5A2MAPTALDH1A1NR4A1SLC10A6

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
CN-115572252-B Isoindolinone inhibitors of MDM2-P53 interaction with anticancer activity 阿斯泰克斯治疗有限公司 2025-02-25 CN disclosed
CN-115572252-A Isoindolinone inhibitors of MDM2-P53 interaction with anti-cancer activity 阿斯泰克斯治疗有限公司 2023-01-06 CN disclosed