SCHEMBL9846997

SCHEMBL9846997

Cc1nccc(N)c1CO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 7/20 0.38
NOS3 P29474 6/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAOA P21397 1/20 0.35
DYRK1A Q13627 1/20 0.35
NOS1 P29475 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 1/20 0.34
P2RX7 Q99572 1/20 0.34
NCF1 P14598 1/20 0.32
CYP2A6 P11509 1/20 0.32
MKNK1 Q9BUB5 1/20 0.32

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
Hydrochloric Acid SCHEMBL9847027 0.98 NOS2 (0.37) NOS2NOS3CYP1A2CYP2D6CYP2C19
SCHEMBL18398543 0.81 NOS2 (0.53) NOS2NOS3CYP1A2KDM4ENOS1
SCHEMBL31214598 0.79 NOS2 (0.38) NOS2NOS3KDM4ENOS1MEN1
SCHEMBL305502 0.78 NOS2 (0.45) NOS2NOS3KDM4EALDH1A1HPGD
SCHEMBL31150926 0.78 NOS2 (0.45) NOS2NOS3KDM4EALDH1A1HPGD
SCHEMBL4912082 0.78 NOS2 (0.56) NOS2NOS3KDM4EALDH1A1HPGD
SCHEMBL3679899 0.77 KDM4E (0.47) CYP1A2CYP2D6CYP2C19HIF1AKDM4E
SCHEMBL9846961 0.76 NOS2 (0.40) NOS2NOS3CYP1A2CYP2D6CYP2C19
SCHEMBL7966532 0.76 MKNK1 (0.37) NOS2NOS3ALDH1A1DYRK1AMKNK1
SCHEMBL24813513 0.75 NCF1 (0.32) NOS2NOS3NCF1RECQL

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688754-A1 KCC2 POTENTIATORS AND USES THEREOF Axonis Therapeutics, Inc. (US) 2026-02-11 EP disclosed
US-20260028351-A1 KCC2 POTENTIATORS AND USES THEREOF AXONIS THERAPEUTICS, INC. 2026-01-29 US disclosed
WO-2024220626-A1 SMALL MOLECULE MODULATORS OF OGG1 AZKARRA THERAPEUTICS, INC. (US) 2024-10-24 WO disclosed
WO-2024211744-A1 KCC2 POTENTIATORS AND USES THEREOF AXONIS THERAPEUTICS, INC. (US) 2024-10-10 WO disclosed
CN-108349960-A New nostoc element compound and conjugate, their preparation and their therapeutical uses 赛诺菲 2018-07-31 CN disclosed
EP-0435222-A2 Aminopyridinylmethanols and aminomethylpyridinamines and related compounds, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-07-03 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20260028351-A1 KCC2 POTENTIATORS AND USES THEREOF GRIN2C, HCN1, KCNC1 NOS2 3832/4885NOS3 2918/4885CYP1A2 2385/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.