SCHEMBL29964652

SCHEMBL29964652

O=C(O)c1ccc(Cl)cc1NC(=O)C1CC1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.65
HSD17B10 Q99714 1/20 0.65
KDM4E B2RXH2 4/20 0.61
ALDH1A1 P00352 3/20 0.61
KMT2A Q03164 2/20 0.61
MEN1 O00255 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
GRIK1 P39086 14/20 0.58
RAB9A P51151 1/20 0.52

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
SCHEMBL29964657 1.00 TSHR (0.65) TSHRHSD17B10KDM4EALDH1A1KMT2A
SCHEMBL1309322 0.94 HSD17B10 (0.66) TSHRHSD17B10KDM4EALDH1A1KMT2A
SCHEMBL1308249 0.93 HSD17B10 (0.64) TSHRHSD17B10KDM4EALDH1A1KMT2A
SCHEMBL28734357 0.81 KMT2A (0.65) ALDH1A1KMT2AMEN1RAB9A
SCHEMBL29721874 0.81 KMT2A (0.65) ALDH1A1KMT2AMEN1RAB9A
SCHEMBL4604120 0.80 ACLY (0.58) KDM4EALDH1A1GRIK1
SCHEMBL29183052 0.80 GRIK1 (0.68) KDM4EALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL3334201 0.79 HDAC1 (0.67) KMT2ARAB9A
Bicarbonate SCHEMBL19664773 0.79 RAB9A (0.69) KDM4EALDH1A1KMT2AMEN1RAB9A
SCHEMBL4617520 0.79 PRSS12 (0.56) KDM4EALDH1A1GRIK1

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
US-20240343704-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2024-10-17 US disclosed
WO-2022226668-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 WO 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-20240343704-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) CMPK1, WNK1, AAK1 TSHR 4610/4885HSD17B10 1998/4885KDM4E 1986/4885

“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.