SCHEMBL26682145

SCHEMBL26682145

Clc1ccn2ncc(Br)c2c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHB3 P54753 4/20 0.43
AXL P30530 1/20 0.35
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
KMO O15229 2/20 0.32
EIF4A3 P38919 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
GLA P06280 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
GRM2 Q14416 1/20 0.30

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
SCHEMBL31383600 0.77 AXL (0.35) AXL
SCHEMBL31383653 0.77 EPHB3 (0.42) EPHB3AXLPIK3CDPIK3CAKMO
SCHEMBL24370193 0.77 EPHB3 (0.43) EPHB3DRD4DRD3PIK3CDPIK3CA
SCHEMBL31383575 0.73 EPHB3 (0.45) EPHB3AXLDRD4DRD3PIK3CA
SCHEMBL3075903 0.73 EPHB3 (0.44) EPHB3DRD4DRD3PIK3CDPIK3CA
SCHEMBL24370197 0.73 EPHB3 (0.41) EPHB3DRD4DRD3PIK3CDPIK3CA
SCHEMBL31383583 0.73 SCN5A (0.38) AXLPIK3CDPIK3CAPIK3CBALDH1A1
SCHEMBL18234159 0.72 EPHB3 (0.32) EPHB3AXLEIF4A3ALDH1A1KDM4E
SCHEMBL24369482 0.72 EPHB3 (0.59) EPHB3DRD4DRD3KMOALDH1A1
SCHEMBL24369877 0.71 EPHB3 (0.42) EPHB3AXLDRD4DRD3EIF4A3

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
US-20250270200-A1 CTPS1 INHIBITORS AND USES THEREOF NIMBUS DISCOVERY, INC. 2025-08-28 US disclosed
US-12331046-B2 CTPS1 inhibitors and uses thereof NIMBUS CLOTHO, INC. (US) 2025-06-17 US disclosed
US-20250051363-A1 Substituted Pyrazolopyridines NEURO3 THERAPEUTICS INC (US) 2025-02-13 US disclosed
WO-2025029897-A1 SUBSTITUTED PYRAZOLOPYRIDINES NEURO3 THERAPEUTICS, INC. (US) 2025-02-06 WO disclosed
WO-2023205475-A1 CTPS1 INHIBITORS AND USES THEREOF NIMBUS CLOTHO, INC. (US) 2023-10-26 WO disclosed
US-20230077316-A1 CTPS1 INHIBITORS AND USES THEREOF NIMBUS DISCOVERY, INC. 2023-03-09 US 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 (4 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-20250051363-A1 Substituted Pyrazolopyridines QDPR, DPYD, P2RX4 EPHB3 2310/4885AXL 3857/4885DRD4 1232/4885
US-20230077316-A1 CTPS1 INHIBITORS AND USES THEREOF CTPS1, CTPS2, ECHS1 EPHB3 4580/4885AXL 4638/4885DRD4 4665/4885
US-20250270200-A1 CTPS1 INHIBITORS AND USES THEREOF CTPS1, CTPS2, ECHS1 EPHB3 4580/4885AXL 4638/4885DRD4 4665/4885
US-12331046-B2 CTPS1 inhibitors and uses thereof CTPS1, CTPS2, ECHS1 EPHB3 4580/4885AXL 4638/4885DRD4 4665/4885

“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.