SCHEMBL18208201

SCHEMBL18208201

COC(=O)C1(CCCl)CCC2(CC1)OCCO2

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45
KMT2A Q03164 4/20 0.36
POLB P06746 2/20 0.33
CYP2C19 P33261 3/20 0.32
CYP2C9 P11712 2/20 0.32
ALDH1A1 P00352 7/20 0.32
MEN1 O00255 2/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
CYP3A4 P08684 1/20 0.30
NPSR1 Q6W5P4 1/20 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
SCHEMBL15564616 0.83 KMT2A (0.41) CYP4F2CYP4A11KMT2APOLBCYP2C19
SCHEMBL12462744 0.74 KMT2A (0.38) KMT2APOLBCYP2C19CYP2C9ALDH1A1
SCHEMBL3198604 0.74 KMT2A (0.38) KMT2APOLBCYP2C19ALDH1A1MEN1
SCHEMBL16142012 0.74 CYP4F2 (0.45) CYP4F2CYP4A11NPSR1
SCHEMBL356203 0.73 CYP4F2 (0.49) CYP4F2CYP4A11CYP2C19CYP2C9ALDH1A1
SCHEMBL21315196 0.73 ALDH1A1 (0.36) CYP4F2CYP4A11KMT2APOLBCYP2C19
SCHEMBL16142018 0.72 CYP4F2 (0.47) CYP4F2CYP4A11POLBNPSR1
SCHEMBL12346121 0.72 ALDH1A1 (0.40) KMT2APOLBCYP2C19CYP2C9ALDH1A1
SCHEMBL9886223 0.72 CYP4F2 (0.51) CYP4F2CYP4A11CYP2C19CYP2C9ALDH1A1
SCHEMBL4003375 0.72 CYP4F2 (0.38) CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180148418-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-05-31 US disclosed
US-20180148418-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-05-31 US disclosed
US-20180148418-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-05-31 US disclosed
EP-3292107-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES Bayer Pharma Aktiengesellschaft (DE) 2018-03-14 EP disclosed
WO-2016177658-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-11-10 WO disclosed
WO-2016177658-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-11-10 WO 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-20180148418-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES C1R, C9, C1S CYP4F2 1422/4885CYP4A11 422/4885KMT2A 3502/4885

“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.