SCHEMBL25620023

SCHEMBL25620023

Cc1cccc(/N=C(\Cl)C(C)C)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.38
CCR8 P51685 1/20 0.38
NPSR1 Q6W5P4 2/20 0.36
MAPT P10636 6/20 0.35
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
KDM4E B2RXH2 5/20 0.35
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
HSD17B10 Q99714 3/20 0.35
NPC1 O15118 2/20 0.35
TP53 P04637 2/20 0.35
MCL1 Q07820 1/20 0.35
MAPK10 P53779 1/20 0.35
NOS3 P29474 1/20 0.35
NOS2 P35228 1/20 0.35
ALDH1A1 P00352 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL20557231 0.82 ALDH1A1 (0.36) SMN1; SMN2ALDH1A1
SCHEMBL20774222 0.81 GRM5 (0.32) GRM5
SCHEMBL21241332 0.75 CCR1 (0.44) CCR1CCR8NPSR1MAPTMEN1
SCHEMBL6248174 0.70
SCHEMBL2304799 0.69 SMN1; SMN2 (0.44) CCR1CCR8NPSR1MAPTMEN1
Hydrochloric Acid SCHEMBL4990819 0.69 CCR1 (0.46) CCR1CCR8NPSR1MAPTMEN1
SCHEMBL8176657 0.68
SCHEMBL10850389 0.63 MAPT (0.40) CCR1CCR8NPSR1MAPTMEN1
SCHEMBL13218429 0.63 CCR1 (0.44) CCR1CCR8NPSR1MAPTMEN1
SCHEMBL7461149 0.63 HTR3E (0.50) MAPTMEN1KMT2ARAB9ASMN1; SMN2

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
US-20230174515-A1 APOPTOSIS SIGNAL-REGULATING KINASE 1 INHIBITORS AND METHODS OF USE THEREOF ENANTA PHARM INC (US) 2023-06-08 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 (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-20230174515-A1 APOPTOSIS SIGNAL-REGULATING KINASE 1 INHIBITORS AND METHODS OF USE THEREOF BAD, CASP1, BAX CCR1 969/4885CCR8 1881/4885NPSR1 3402/4885

“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.