SCHEMBL102210

SCHEMBL102210

CC=Cc1cc(C(O)(C(F)(F)F)C(F)(F)F)ccc1N1CC(C)NCC1C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 8/20 0.36
NR1H3 Q13133 8/20 0.36
RORC P51449 8/20 0.33
NR1I2 O75469 4/20 0.33
MCHR1 Q99705 1/20 0.31
HTR2C P28335 2/20 0.30
HTR2B P41595 2/20 0.30
GCKR Q14397 2/20 0.30

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
SCHEMBL102209 1.00 NR1H2 (0.36) NR1H2NR1H3RORCNR1I2MCHR1
SCHEMBL102211 1.00 NR1H2 (0.36) NR1H2NR1H3RORCNR1I2MCHR1
SCHEMBL102208 1.00 NR1H2 (0.36) NR1H2NR1H3RORCNR1I2MCHR1
SCHEMBL16549825 0.83 SIGMAR1 (0.31) MCHR1
SCHEMBL3595439 0.83 RAD52 (0.36) NR1H2NR1H3RORCNR1I2HTR2C
SCHEMBL3595444 0.83 RAD52 (0.36) NR1H2NR1H3RORCNR1I2HTR2C
SCHEMBL3595436 0.83 RAD52 (0.36) NR1H2NR1H3RORCNR1I2HTR2C
SCHEMBL3595442 0.83 RAD52 (0.36) NR1H2NR1H3RORCNR1I2HTR2C
SCHEMBL105424 0.81
SCHEMBL105423 0.81

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
EP-2426113-B1 CARBINOL COMPOUND HAVING HETEROCYCLIC LINKER KOWA CO (JP) 2013-11-06 EP disclosed
US-8551985-B2 Carbinol derivatives having heterocyclic linker KOWA COMPANY, LTD. (JP) 2013-10-08 US disclosed
EP-2426113-A1 CARBINOL COMPOUND HAVING HETEROCYCLIC LINKER Kowa Company, Ltd. (JP) 2012-03-07 EP disclosed
US-20100280013-A1 CARBINOL DERIVATIVES HAVING HETEROCYCLIC LINKER KOWA COMPANY, LTD. (JP) 2010-11-04 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-20100280013-A1 CARBINOL DERIVATIVES HAVING HETEROCYCLIC LINKER NR1H2, NR1H3, CCR2 NR1H2 1/4885NR1H3 2/4885RORC 19/4885

“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.