SCHEMBL24852509

SCHEMBL24852509

Cc1snnc1-c1nnc(Cc2cc3ccccc3[nH]c2=O)o1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GUSB P08236 3/20 0.43
▸ IL4I1 Q96RQ9 5/20 0.43
▸ BRD4 O60885 1/20 0.41
▸ KDM4E B2RXH2 5/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HSD17B10 Q99714 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ EGFR P00533 3/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ ERBB2 P04626 1/20 0.38
▸ PDE10A Q9Y233 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL24852506 0.82 KDM4E (0.46) GUSBIL4I1BRD4KDM4EALDH1A1
SCHEMBL24852000 0.80 EGFR (0.55) GUSBIL4I1ALDH1A1HPGDHSD17B10
SCHEMBL24852507 0.80 IL4I1 (0.51) IL4I1BRD4KDM4EALDH1A1HPGD
SCHEMBL24852500 0.79 GUSB (0.44) GUSBIL4I1BRD4KDM4EALDH1A1
SCHEMBL24851962 0.77 IL4I1 (0.51) IL4I1BRD4KDM4EALDH1A1HPGD
SCHEMBL24851907 0.77 GUSB (0.47) GUSBIL4I1BRD4KDM4EALDH1A1
SCHEMBL24852045 0.77 IL4I1 (0.43) GUSBIL4I1BRD4KDM4EALDH1A1
SCHEMBL24851999 0.76 GUSB (0.56) GUSBIL4I1KDM4EALDH1A1HPGD
SCHEMBL24851924 0.76 GUSB (0.46) GUSBIL4I1KDM4EALDH1A1HPGD
SCHEMBL24852005 0.74 GUSB (0.47) GUSBIL4I1HSD17B10EGFRERBB2

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-2023278222-A1 IL4I1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2023-01-05 — — WO disclosed
Send feedback