SCHEMBL10128510

SCHEMBL10128510

FC(F)(F)c1ccccc1N1CC2CNCC2C1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 1/20 0.51
RBP4 P02753 3/20 0.46
KMT2A Q03164 1/20 0.43
CHRNA7 P36544 4/20 0.41
CHRNB2 P17787 3/20 0.41
CHRNA4 P43681 3/20 0.41
AKR1C3 P42330 1/20 0.40
HSD11B1 P28845 2/20 0.40

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
SCHEMBL17515577 1.00 BPTF (0.51) BPTFRBP4KMT2ACHRNA7CHRNB2
Hydrochloric Acid SCHEMBL17502965 0.98 BPTF (0.50) BPTFRBP4KMT2ACHRNA7CHRNB2
Hydrochloric Acid SCHEMBL1394230 0.98 BPTF (0.50) BPTFRBP4KMT2ACHRNA7CHRNB2
SCHEMBL19614564 0.79 NOTUM (0.48) RBP4KMT2AAKR1C3HSD11B1
SCHEMBL23744698 0.78 RBP4 (0.44) RBP4KMT2AAKR1C3HSD11B1
SCHEMBL30345809 0.78 RBP4 (0.44) RBP4KMT2AAKR1C3HSD11B1
SCHEMBL30345707 0.78 RBP4 (0.44) RBP4KMT2AAKR1C3HSD11B1
SCHEMBL23744701 0.78 RBP4 (0.44) RBP4KMT2AAKR1C3HSD11B1
SCHEMBL20533587 0.78 RBP4 (0.50) RBP4KMT2AAKR1C3HSD11B1
SCHEMBL22720929 0.77 BPTF (0.56) BPTFKMT2ACHRNA7CHRNB2CHRNA4

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-20120010186-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE MERCK FROSST CANADA LTD. (CA) 2012-01-12 US disclosed
WO-2010108268-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE MERCK FROSST CANADA LTD. (CA) 2010-09-30 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-20120010186-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE SCD, SCD5, FASN BPTF 1712/4885RBP4 602/4885KMT2A 3367/4885

“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.