SCHEMBL4900256

SCHEMBL4900256

CCCc1ccc2c(c1)Cc1cc(CCC)ccc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.50
CNR2 P34972 1/20 0.50
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PDK2 Q15119 1/20 0.42
HTR2C P28335 4/20 0.41
HTR2B P41595 3/20 0.41
HTR2A P28223 2/20 0.41
RAB9A P51151 4/20 0.41
GPR84 Q9NQS5 1/20 0.40
ALOX5 P09917 1/20 0.40
NPC1 O15118 3/20 0.39
MAPT P10636 1/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DRD2 P14416 1/20 0.39
SLC6A2 P23975 1/20 0.39

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
SCHEMBL5684088 0.89 CNR1 (0.42) CNR1CNR2TSHRALDH1A1ATM
SCHEMBL28302882 0.89 CNR1 (0.42) CNR1CNR2TSHRALDH1A1ATM
SCHEMBL4889569 0.88 SKP2 (0.47) TSHRALDH1A1ATMNPSR1HTR2C
SCHEMBL4886467 0.87 CNR1 (0.55) CNR1CNR2TSHRALDH1A1ATM
Ammonia Solution, Strong SCHEMBL2441862 0.87 CNR1 (0.45) CNR1CNR2PDK2HTR2CHTR2B
SCHEMBL2930325 0.86 HTR2A (0.52) ALDH1A1HTR2CHTR2ATP53DRD2
SCHEMBL31228811 0.86 HTR2A (0.52) ALDH1A1HTR2CHTR2ATP53DRD2
SCHEMBL28946730 0.85 GPR84 (0.39) CNR1CNR2TSHRALDH1A1ATM
SCHEMBL4898274 0.84 HTR2A (0.55) ALDH1A1HTR2CHTR2ATP53DRD2
SCHEMBL4900272 0.84 HTR2A (0.55) ALDH1A1HTR2CHTR2ATP53DRD2

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-8084559-B2 Ethylene-vinylcyclohexane copolymers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-27 US disclosed
US-20080161514-A1 Transition Metal Complex, Process For Producing Said Transition Metal Complex, Substituent-Carrying Fluorene Compound, Process For Producing Said Fluorene Compound, Catalyst Component For Olefin Polymerization, Catalyst For Olefin Polymerization, and Process For Producing Olefin Polymer SUMITOMO CHEMICAL COMPANY, LIMTIED (JP) 2008-07-03 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-20080161514-A1 Transition Metal Complex, Process For Producing Said Transition Metal Complex, Substituent-Carrying Fluorene Compound, Process For Producing Said Fluorene Compound, Catalyst Component For Olefin Polymerization, Catalyst For Olefin Polymerization, and Process For Producing Olefin Polymer AOC2, ACSL1, ACSL3 CNR1 2078/4885CNR2 2221/4885TSHR 3725/4885

“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.