SCHEMBL26230992

SCHEMBL26230992

Cc1cc(CCCBr)cc(C)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.39
CHRM1 P11229 1/20 0.39
ALOX15 P16050 1/20 0.39
MAOA P21397 1/20 0.39
TBXA2R P21731 1/20 0.39
ADRA1A P35348 1/20 0.39
HTR2B P41595 1/20 0.39
MCL1 Q07820 3/20 0.39
BCL2L1 Q07817 2/20 0.39
SKP2 Q13309 1/20 0.37
RAPGEF4 Q8WZA2 4/20 0.34
HPGD P15428 2/20 0.32
MAPK1 P28482 2/20 0.32
NPC1 O15118 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GPR84 Q9NQS5 1/20 0.30
TP53 P04637 1/20 0.30
POLB P06746 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
SCHEMBL20412274 0.78 PTGS2 (0.52) CYP3A4CHRM1SKP2HPGDMAPK1
SCHEMBL20020024 0.78 MAOA (0.39) CYP3A4CHRM1ALOX15MAOATBXA2R
SCHEMBL81436 0.78 SKP2 (0.46) ALOX15SKP2TP53
SCHEMBL15787530 0.77 MAOA (0.43) CYP3A4CHRM1ALOX15MAOATBXA2R
SCHEMBL12671956 0.75 TDP1 (0.35) CYP3A4ALOX15HPGDMAPK1NPC1
SCHEMBL27638283 0.75 RAPGEF4 (0.32) CYP3A4CHRM1ALOX15MAOATBXA2R
SCHEMBL24668666 0.75 SKP2 (0.33) SKP2MAPK1NPC1RAB9A
SCHEMBL80576 0.75 TSHR (0.40) CYP3A4ALOX15TP53TSHR
SCHEMBL79338 0.75 NPC1 (0.35) CYP3A4ALOX15SKP2HPGDMAPK1
SCHEMBL79106 0.74 SKP2 (0.50) CYP3A4ALOX15SKP2

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-11760752-B2 Carboxylic acid, acyl sulfonamide and acyl sulfamide-derivatized bicyclic aza-heteroaromatics as selective Mcl-1 inhibitors and as dual Mcl-1/Bcl-2 inhibitors UNIVERSITY OF MARYLAND, BALTIMORE (US) 2023-09-19 US disclosed
US-11760752-B2 Carboxylic acid, acyl sulfonamide and acyl sulfamide-derivatized bicyclic aza-heteroaromatics as selective Mcl-1 inhibitors and as dual Mcl-1/Bcl-2 inhibitors UNIVERSITY OF MARYLAND, BALTIMORE (US) 2023-09-19 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-11760752-B2 Carboxylic acid, acyl sulfonamide and acyl sulfamide-derivatized bicyclic aza-heteroaromatics as selective Mcl-1 inhibitors and as dual Mcl-1/Bcl-2 inhibitors MCL1, BCLAF1, BCL2A1 CYP3A4 4063/4885CHRM1 4801/4885ALOX15 1733/4885

“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.