SCHEMBL10140921

SCHEMBL10140921

COC(=O)c1c(OCc2ccc(C)cc2)c(-c2ccc(N3CCCCC3=O)cc2)nn1C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
TSHR P16473 2/20 0.41
HTT P42858 2/20 0.41
GALR3 O60755 1/20 0.41
KIT P10721 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
F10 P00742 3/20 0.39
HPGD P15428 2/20 0.38
PKM P14618 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
USP2 O75604 1/20 0.37
MAPT P10636 1/20 0.37
TNIK Q9UKE5 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ACACB O00763 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL10173113 0.92 F10 (0.47) LMNATSHRF10HPGDMAPT
SCHEMBL10140919 0.91 LMNA (0.41) LMNATSHRHTTGALR3KIT
SCHEMBL10173114 0.84 F10 (0.48) LMNAF10MEN1KMT2AMAPT
SCHEMBL10140911 0.81 MAPT (0.41) LMNAHTTSMN1; SMN2L3MBTL1HPGD
SCHEMBL10172563 0.72 PTGDR2 (0.43) HTTSMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL609322 0.68 ALDH1A1 (0.56) LMNAHTTSMN1; SMN2HPGDPKM
SCHEMBL4195522 0.68 ALDH1A1 (0.62) LMNATSHRSMN1; SMN2F10HPGD
SCHEMBL8357667 0.67 ALDH1A1 (0.49) LMNATSHRF10HPGDMEN1
SCHEMBL4461794 0.67 AKR1C3 (0.55) LMNATSHRHTTSMN1; SMN2HPGD
SCHEMBL4690924 0.67 HPGD (0.61) LMNATSHRSMN1; SMN2F10HPGD

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-8148363-B2 Heterocyclic compounds as factor IXA inhibitors SCHERING CORPORATION (US) 2012-04-03 US disclosed
US-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-03-17 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-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS F9, F12, F8 LMNA 248/4885TSHR 2666/4885HTT 3243/4885

“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.