SCHEMBL15901130

SCHEMBL15901130

COc1cc(I)ccc1C1CC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.43
HTR2A P28223 6/20 0.40
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
DRD2 P14416 1/20 0.37
CNR2 P34972 3/20 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
SCHEMBL17376358 0.88 HTR2C (0.61) HTR2CHTR2A
SCHEMBL29361990 0.82 HPGD (0.45) HTR2CHTR2AKMT2ADRD2
SCHEMBL23268487 0.78 MEN1 (0.58) HTR2CMEN1KMT2A
SCHEMBL31172738 0.78 MEN1 (0.58) HTR2CMEN1KMT2A
SCHEMBL12180448 0.78 ACHE (0.54) HTR2CHTR2AMEN1KMT2ADRD2
SCHEMBL3692141 0.78 MEN1 (0.58) HTR2CMEN1KMT2A
SCHEMBL18123010 0.77 HTR2C (0.43) HTR2CHTR2AMEN1KMT2A
SCHEMBL16957367 0.77 HTR2C (0.43) HTR2CHTR2AMEN1KMT2ADRD2
SCHEMBL16554269 0.77 MAOB (0.53) HTR2CHTR2AMEN1KMT2A
SCHEMBL24595061 0.77 HTR2C (0.47) HTR2CHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2948442-B1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INT (DE) 2016-10-26 EP disclosed
US-8877741-B2 Pyrrolidine derivatives, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-11-04 US disclosed
US-20140213568-A1 Pyrrolidine derivatives, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-07-31 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-20140213568-A1 Pyrrolidine derivatives, pharmaceutical compositions and uses thereof PEPD, PGA5, PYCR1 HTR2C 2510/4885HTR2A 2639/4885MEN1 3370/4885

“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.