SCHEMBL20103362

SCHEMBL20103362

CCOC(=O)C1CC=C(c2cc(OC)ccc2Cl)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
POLB P06746 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 3/20 0.43
MAPT P10636 2/20 0.43
CDK9 P50750 2/20 0.42
CCNT1 O60563 1/20 0.42
TSHR P16473 5/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPK1 P28482 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 2/20 0.40
GAA P10253 3/20 0.40
RORC P51449 1/20 0.40
HPGD P15428 1/20 0.39
CASP1 P29466 1/20 0.39
HSD17B10 Q99714 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
SCHEMBL20103466 0.87 CDK9 (0.46) ALDH1A1POLBTDP1KDM4EMAPT
SCHEMBL31638769 0.84 ALDH1A1 (0.42) ALDH1A1POLBTDP1KDM4EMAPT
SCHEMBL31639075 0.84 RORC (0.45) ALDH1A1POLBTDP1KDM4EMAPT
SCHEMBL31638826 0.84 ALDH1A1 (0.42) ALDH1A1POLBTDP1KDM4EMAPT
SCHEMBL15919061 0.81 NPC1 (0.46) ALDH1A1POLBTDP1KDM4EMAPT
SCHEMBL1289692 0.81 ALDH1A1 (0.47) ALDH1A1POLBTDP1KDM4EMAPT
SCHEMBL9810622 0.77 GAA (0.43) ALDH1A1POLBTDP1KDM4EMAPT
SCHEMBL20719178 0.77 CDK9 (0.41) ALDH1A1POLBKDM4EMAPTCDK9
SCHEMBL20103431 0.76 ESR2 (0.46) ALDH1A1TDP1MAPTCDK9CCNT1
SCHEMBL2510859 0.76 CDK9 (0.54) CDK9CCNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10988433-B2 Cyclohexyl GPR40 agonists for the treatment of type II diabetes JANSSEN PHARMACEUTICA NV (BE) 2021-04-27 US disclosed
US-10988433-B2 Cyclohexyl GPR40 agonists for the treatment of type II diabetes JANSSEN PHARMACEUTICA NV (BE) 2021-04-27 US disclosed
US-20200039914-A1 CYCLOHEXYL GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN RESEARCH & DEVELOPMENT, LLC 2020-02-06 US disclosed
US-20200039914-A1 CYCLOHEXYL GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN RESEARCH & DEVELOPMENT, LLC 2020-02-06 US disclosed
WO-2018081047-A1 CYCLOHEXYL GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 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 (2 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-20200039914-A1 CYCLOHEXYL GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES GPR119, GPR65, GPR55 ALDH1A1 2898/4885POLB 3629/4885TDP1 4755/4885
US-10988433-B2 Cyclohexyl GPR40 agonists for the treatment of type II diabetes GPR119, GPR65, GPR55 ALDH1A1 2898/4885POLB 3629/4885TDP1 4755/4885

“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.