SCHEMBL10035627

SCHEMBL10035627

COc1cc2c(cc1OC)CN(CCCNS(=O)(=O)c1c(C)ccc3nsnc13)CC2

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TMEM97 Q5BJF2 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
HTR7 P34969 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPK1 P28482 1/20 0.43
ALOX15 P16050 1/20 0.43

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
SCHEMBL10035574 0.85 MEN1 (0.58) MEN1KMT2AHTR7SMN1; SMN2ALDH1A1
SCHEMBL8981937 0.83 MEN1 (0.57) ABCB1MEN1KMT2AHTR7SMN1; SMN2
SCHEMBL10035586 0.80 ABCB1 (0.54) ABCB1TMEM97SIGMAR1HTR7
SCHEMBL10035619 0.80 ABCB1 (0.54) ABCB1TMEM97SIGMAR1HTR7
SCHEMBL10035605 0.80 ABCB1 (0.56) ABCB1TMEM97SIGMAR1HTR7
Hydrochloric Acid SCHEMBL2139849 0.80 ABCB1 (0.53) ABCB1TMEM97SIGMAR1HTR7
Hydrochloric Acid SCHEMBL2138435 0.80 ABCB1 (0.53) ABCB1TMEM97SIGMAR1
Hydrochloric Acid SCHEMBL5395710 0.79 ABCB1 (0.55) ABCB1TMEM97SIGMAR1
SCHEMBL2139371 0.79 CCR1 (0.53) ABCB1TMEM97SIGMAR1HTR7
SCHEMBL10035589 0.79 ABCB1 (0.52) ABCB1TMEM97SIGMAR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148397-B2 5-HT7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2012-04-03 US disclosed
US-8148397-B2 5-HT7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2012-04-03 US disclosed
US-20090088450-A1 5-ht7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-04-02 US disclosed
US-20090088450-A1 5-ht7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-04-02 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-20090088450-A1 5-ht7 receptor antagonists HTR7, HTR1A, HTR5A ABCB1 551/4885MEN1 1093/4885KMT2A 2533/4885

“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.