SCHEMBL4450192

SCHEMBL4450192

Cc1cccc(C2CC(C)CCC2C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.49
HTR2A P28223 1/20 0.49
SLC6A4 P31645 1/20 0.49
HTR2B P41595 1/20 0.49
SLC6A3 Q01959 1/20 0.49
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
DPP4 P27487 1/20 0.38
ACHE P22303 1/20 0.37
LPAR2 Q9HBW0 1/20 0.36
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36
DRD4 P21917 1/20 0.36
DRD5 P21918 1/20 0.36
DRD3 P35462 1/20 0.36
NPC1 O15118 1/20 0.35
HPN P05981 1/20 0.35
FFAR1 O14842 1/20 0.35
CCR5 P51681 1/20 0.34
HSD11B1 P28845 2/20 0.34

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
SCHEMBL5682494 0.80 MAOB (0.45) HTR2CHTR2AHTR2BSLC6A3MEN1
SCHEMBL21568447 0.79 HTR2C (0.47) HTR2CHTR2ASLC6A4HTR2BSLC6A3
SCHEMBL4452713 0.78 HTR2A (0.43) HTR2CHTR2ASLC6A4HTR2BSLC6A3
SCHEMBL21568446 0.74 HTR2C (0.65) HTR2CHTR2ASLC6A4HTR2BSLC6A3
SCHEMBL27104708 0.73 UHRF1 (0.37)
SCHEMBL21568453 0.72 HTR2C (0.53) HTR2CHTR2ASLC6A4HTR2BSLC6A3
SCHEMBL7092556 0.72 HTR2C (0.61) HTR2CHTR2ASLC6A4HTR2BSLC6A3
SCHEMBL7002711 0.72 HTR2C (0.61) HTR2CHTR2ASLC6A4HTR2BSLC6A3
SCHEMBL7002709 0.72 HTR2C (0.61) HTR2CHTR2ASLC6A4HTR2BSLC6A3
SCHEMBL20927311 0.71 HTR2C (0.41) HTR2CHTR2ASLC6A4HTR2BSLC6A3

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-20090299111-A1 (ALKYLPHENYL) ALKYLCYCLOHEXANE AND METHOD FOR PRODUCING (ALKYLPHENYL) ALKYLCYCLOHEXANE OR ALKYLBIPHENYL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2009-12-03 US disclosed
EP-1908743-A1 (ALKYLPHENYL)ALKYLCYCLOHEXANE AND METHOD FOR PRODUCING (ALKYLPHENYL)ALKYLCYCLOHEXANE OR ALKYLBIPHENYL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2008-04-09 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-20090299111-A1 (ALKYLPHENYL) ALKYLCYCLOHEXANE AND METHOD FOR PRODUCING (ALKYLPHENYL) ALKYLCYCLOHEXANE OR ALKYLBIPHENYL CCNA2, ACACB, PARP8 HTR2C 2280/4885HTR2A 2578/4885SLC6A4 4780/4885

“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.