SCHEMBL17147609

SCHEMBL17147609

C[C@@H]1CC[C@H](c2cccc(C(F)(F)F)c2)C1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.58
DRD2 P14416 1/20 0.52
HTR2A P28223 4/20 0.47
HTR2B P41595 4/20 0.47
KDM1A O60341 1/20 0.43
RCOR1 Q9UKL0 1/20 0.43
HRH3 Q9Y5N1 2/20 0.42
HTR1A P08908 1/20 0.41

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
SCHEMBL14945605 1.00 HTR2C (0.58) HTR2CDRD2HTR2AHTR2BKDM1A
SCHEMBL13197434 0.90 HTR2C (0.66) HTR2CDRD2HTR2AHTR2BKDM1A
SCHEMBL13197435 0.90 HTR2C (0.66) HTR2CDRD2HTR2AHTR2BKDM1A
SCHEMBL25089783 0.88 HTR2C (0.58) HTR2CDRD2HTR2AHTR2BKDM1A
SCHEMBL24065185 0.88 HTR2C (0.58) HTR2CDRD2HTR2AHTR2BKDM1A
SCHEMBL24065187 0.88 HTR2C (0.58) HTR2CDRD2HTR2AHTR2BKDM1A
SCHEMBL1065758 0.84 HTR2C (0.77) HTR2CDRD2HTR2AHTR2BKDM1A
SCHEMBL19102563 0.81 HTR2C (0.58) HTR2CDRD2HTR2AHTR2BKDM1A
SCHEMBL17147622 0.81 HTR2C (0.58) HTR2CDRD2HTR2AHTR2BKDM1A
SCHEMBL17147616 0.80 HTR2C (0.53) HTR2CKDM1ARCOR1

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-9422319-B2 Bisaryl metallocenes and use thereof to produce polyolefins BASELL POLYOLEFINE GMBH (DE) 2016-08-23 US disclosed
US-20150284418-A1 BISARYL METALLOCENES AND USE THEREOF TO PRODUCE POLYOLEFINS BASELL POLYOLEFIN GMBH (DE) 2015-10-08 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-20150284418-A1 BISARYL METALLOCENES AND USE THEREOF TO PRODUCE POLYOLEFINS PCBP1, PARG, PARN HTR2C 3282/4885DRD2 3518/4885HTR2A 2670/4885

“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.