SCHEMBL2269140

SCHEMBL2269140

OC1(c2cc(F)c(F)c(F)c2)CCNCC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.48
CCR1 P32246 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
OPRM1 P35372 2/20 0.34
CCNT1 O60563 1/20 0.32
CDK9 P50750 1/20 0.32
HTR2C P28335 3/20 0.32
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31

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
SCHEMBL373752 0.82 DRD2 (0.50) DRD2SIGMAR1OPRM1CCNT1CDK9
SCHEMBL26929234 0.81 CCR1 (0.37) CCR1OPRM1CES2CES1
SCHEMBL533971 0.81 DRD2 (0.59) DRD2SIGMAR1
Hydrochloric Acid SCHEMBL973810 0.80 DRD2 (0.48) DRD2SIGMAR1OPRM1CCNT1CDK9
Hydrochloric Acid SCHEMBL22616883 0.79 DRD2 (0.58) DRD2SIGMAR1
SCHEMBL747357 0.78 DRD2 (0.51) DRD2SIGMAR1OPRM1
SCHEMBL2272286 0.77 DRD2 (0.50) DRD2SIGMAR1OPRM1CCNT1CDK9
SCHEMBL2274203 0.77 DRD2 (0.59) DRD2CCR1
SCHEMBL2270541 0.74 DRD2 (0.56) DRD2SIGMAR1CCNT1CDK9
SCHEMBL2273078 0.74 OPRM1 (0.50) DRD2SIGMAR1OPRM1CCNT1CDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1714961-B1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2015-12-09 EP disclosed
US-7994196-B2 Indazole compound and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-08-09 US disclosed
US-7994196-B2 Indazole compound and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-08-09 US disclosed
US-7994196-B2 Indazole compound and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-08-09 US disclosed
US-20070173537-A1 Indazole compound and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2007-07-26 US disclosed
US-20070173537-A1 Indazole compound and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2007-07-26 US disclosed
US-20070173537-A1 Indazole compound and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2007-07-26 US disclosed
EP-1714961-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2006-10-25 EP 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-20070173537-A1 Indazole compound and pharmaceutical use thereof CYP3A5, CYP3A43, TP53 DRD2 3805/4885CCR1 3991/4885SIGMAR1 3731/4885

“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.