SCHEMBL31305228

SCHEMBL31305228

Cc1ccc(NC(=O)Oc2ccccc2)cc1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.65
▸ MAPT P10636 7/20 0.65
▸ KDM4E B2RXH2 5/20 0.65
▸ MAPK1 P28482 3/20 0.59
▸ CYP1A2 P05177 2/20 0.59
▸ CYP2D6 P10635 2/20 0.59
▸ HSD17B10 Q99714 2/20 0.59
▸ CYP2C9 P11712 1/20 0.59
▸ HPGD P15428 1/20 0.59
▸ ALOX15 P16050 1/20 0.59
▸ CYP2C19 P33261 1/20 0.59
▸ CASP3 P42574 1/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ SENP8 Q96LD8 1/20 0.59
▸ SENP7 Q9BQF6 1/20 0.59
▸ SENP6 Q9GZR1 1/20 0.59
▸ POLB P06746 2/20 0.57
▸ KMT2A Q03164 4/20 0.56
▸ MEN1 O00255 3/20 0.56
▸ THRB P10828 1/20 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
SCHEMBL16000906 0.88 ALDH1A1 (0.64) ALDH1A1MAPTKDM4EMAPK1CYP1A2
SCHEMBL989117 0.85 ALDH1A1 (0.60) ALDH1A1MAPTKDM4EMAPK1CYP1A2
SCHEMBL8065645 0.84 ALDH1A1 (0.59) ALDH1A1MAPTKDM4EMAPK1CYP1A2
SCHEMBL61187 0.84 POLB (0.71) ALDH1A1MAPTKDM4ECYP1A2CYP2C9
SCHEMBL29739620 0.84 ALDH1A1 (0.59) ALDH1A1MAPTKDM4ECYP1A2RAB9A
SCHEMBL29739277 0.82 POLB (0.69) ALDH1A1MAPTKDM4EMAPK1CYP1A2
SCHEMBL13593024 0.82 MAPT (0.57) ALDH1A1MAPTKDM4ECYP1A2POLB
SCHEMBL8603028 0.82 MAPT (0.78) ALDH1A1MAPTKDM4EMAPK1CYP1A2
SCHEMBL15374817 0.81 ALDH1A1 (0.60) ALDH1A1MAPTKDM4EMAPK1CYP1A2
SCHEMBL8652810 0.81 MAPT (0.76) ALDH1A1MAPTKDM4EMAPK1CYP1A2

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
WO-2024238872-A2 ISOINDOLINONE-GLUTARIMIDE ANTIBODY CONJUGATES, AND USES THEREOF FIREFLY BIO, INC. (US) 2024-11-21 — — WO disclosed
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