SCHEMBL25678232

SCHEMBL25678232

CNc1ccc(N)cc1NC(=O)C1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
GAA P10253 1/20 0.56
HDAC1 Q13547 9/20 0.55
HDAC2 Q92769 9/20 0.55
HDAC3 O15379 6/20 0.55
SMN1; SMN2 Q16637 2/20 0.51
MEN1 O00255 1/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
GFER P55789 1/20 0.51
CETP P11597 1/20 0.48
LMNA P02545 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
KDM4E B2RXH2 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PTPN1 P18031 1/20 0.45

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
SCHEMBL28587997 0.82 SMN1; SMN2 (0.68) KMT2AGAAHDAC1HDAC2HDAC3
SCHEMBL25845880 0.81 HDAC3 (0.60) KMT2AGAAHDAC1HDAC2HDAC3
SCHEMBL12791628 0.79 CETP (0.64) KMT2AGAAHDAC1HDAC2HDAC3
SCHEMBL27884370 0.76 CYP1A2 (0.55) KMT2AGAAHDAC1HDAC2HDAC3
SCHEMBL678484 0.73 PTPN1 (0.74) KMT2AGAAHDAC1HDAC2HDAC3
SCHEMBL24730776 0.73 KMT2A (0.51) KMT2AHDAC1HDAC2SMN1; SMN2MEN1
SCHEMBL4218895 0.73 ALDH1A1 (0.68) HDAC1HDAC2HDAC3SMN1; SMN2LMNA
SCHEMBL29948499 0.73 KMT2A (0.51) KMT2AHDAC1HDAC2SMN1; SMN2MEN1
SCHEMBL26122265 0.73 KMT2A (0.59) KMT2AGAAHDAC1HDAC2HDAC3
SCHEMBL20332958 0.73 ALDH1A1 (0.68) HDAC1HDAC2HDAC3SMN1; SMN2LMNA

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-20230203010-A1 BICYCLIC AMINE CDK12 INHIBITORS INCYTE CORPORATION 2023-06-29 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-20230203010-A1 BICYCLIC AMINE CDK12 INHIBITORS CDK12, CDK1, CDK2 KMT2A 289/4885GAA 4316/4885HDAC1 321/4885

“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.