SCHEMBL20103492

SCHEMBL20103492

NC(=O)C[C@H](c1cccc(OCc2ccccc2)c1)C1CC1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
FFAR1 O14842 9/20 0.56
SPHK1 Q9NYA1 2/20 0.49
SPHK2 Q9NRA0 2/20 0.49
KCNH2 Q12809 1/20 0.49
FFAR2 O15552 1/20 0.48
NR4A2 P43354 1/20 0.48
ALOX5 P09917 1/20 0.47

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
SCHEMBL21644966 1.00 KMT2A (0.59) KMT2ASMN1; SMN2FFAR1SPHK1SPHK2
SCHEMBL29454542 0.90 FFAR1 (0.66) KMT2ASMN1; SMN2FFAR1FFAR2
SCHEMBL21644908 0.90 FFAR1 (0.66) KMT2ASMN1; SMN2FFAR1FFAR2
SCHEMBL20103403 0.90 FFAR1 (0.66) KMT2ASMN1; SMN2FFAR1FFAR2
SCHEMBL29454681 0.88 KMT2A (0.56) KMT2ASMN1; SMN2FFAR1FFAR2NR4A2
SCHEMBL21644935 0.86 FFAR1 (0.59) KMT2ASMN1; SMN2FFAR1FFAR2ALOX5
SCHEMBL29454565 0.86 FFAR1 (0.59) KMT2ASMN1; SMN2FFAR1FFAR2ALOX5
SCHEMBL20103667 0.86 FFAR1 (0.59) KMT2ASMN1; SMN2FFAR1FFAR2ALOX5
SCHEMBL30211110 0.84 FFAR1 (0.53) KMT2ASMN1; SMN2FFAR1SPHK1SPHK2
SCHEMBL22717572 0.84 FFAR1 (0.53) KMT2ASMN1; SMN2FFAR1SPHK1SPHK2

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 KMT2A 3114/4885SMN1; SMN2 4068/4885FFAR1 16/4885
US-10988433-B2 Cyclohexyl GPR40 agonists for the treatment of type II diabetes GPR119, GPR65, GPR55 KMT2A 3114/4885SMN1; SMN2 4068/4885FFAR1 16/4885

“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.