SCHEMBL31132830

SCHEMBL31132830

O=C(O)c1ccncc1CO

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 20/20 0.55
KDM6B O15054 8/20 0.55
KDM4D Q6B0I6 5/20 0.55
KDM4E B2RXH2 2/20 0.55
KDM4A O75164 2/20 0.55
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
MAPT P10636 1/20 0.55
THRB P10828 1/20 0.55
KMT2A Q03164 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
EGLN3 Q9H6Z9 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
SCHEMBL31132789 1.00 KDM4C (0.55) KDM4CKDM6BKDM4DKDM4EKDM4A
SCHEMBL30100781 0.84 KDM4C (0.56) KDM4CKDM6BKDM4DKDM4EKDM4A
SCHEMBL115648 0.84 KDM4C (0.56) KDM4CKDM6BKDM4DKDM4EKDM4A
SCHEMBL3880004 0.84 KDM4C (0.50) KDM4CKDM6BKDM4DKDM4EKDM4A
SCHEMBL30980592 0.82 KDM4C (0.53) KDM4CKDM6BKDM4DKDM4EKDM4A
SCHEMBL7964096 0.82 KDM4C (0.53) KDM4CKDM6BKDM4DKDM4EKDM4A
SCHEMBL18421593 0.82 TDP1 (0.52) KDM4CKDM6BKDM4DKDM4EKDM4A
SCHEMBL17442725 0.82 KDM4C (0.53) KDM4CKDM6BKDM4DKDM4EKDM4A
SCHEMBL10467610 0.82 KDM4C (0.53) KDM4CKDM6BKDM4DKDM4EKDM4A
Hydrochloric Acid SCHEMBL1026385 0.82 KDM4C (0.54) KDM4CKDM6BKDM4DKDM4EKDM4A

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
EP-4704830-A2 MRGPRX2 INHIBITORS AND METHODS OF USE THEREOF Septerna, Inc. (US) 2026-03-11 EP disclosed
WO-2024226914-A2 MRGPRX2 ANTAGONISTS AND METHODS OF USE THEREOF SEPTERNA, INC. (US) 2024-10-31 WO disclosed