SCHEMBL18501530

SCHEMBL18501530

CCOc1c(CO)noc1-c1cc(C)ccc1F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 2/20 0.34
MAPT P10636 5/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
TP53 P04637 3/20 0.34
RXFP1 Q9HBX9 1/20 0.34
THRB P10828 1/20 0.34
POLB P06746 2/20 0.33
DHODH Q02127 1/20 0.33
CTSA P10619 4/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPK1 P28482 1/20 0.32
MAP2K4 P45985 1/20 0.32
MAPKAPK2 P49137 1/20 0.32
MAPKAPK3 Q16644 1/20 0.32

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
SCHEMBL18501524 0.81 FFAR4 (0.34) NPC1RAB9APOLBKDM4E
SCHEMBL18501532 0.72 TDP2 (0.42) TP53THRBDHODH
SCHEMBL18490300 0.71 FFAR1 (0.38) MAPTNPC1RAB9ATP53KDM4E
SCHEMBL18501529 0.71 TDP2 (0.41) TP53THRBDHODH
SCHEMBL11993197 0.70 MAPT (0.35) MAPTNPC1RAB9ATP53CTSA
SCHEMBL18490195 0.68 FFAR4 (0.39) KDM4E
SCHEMBL18501523 0.67 TDP2 (0.37) SMN1; SMN2NPC1RAB9ATP53THRB
SCHEMBL18490055 0.67 FFAR1 (0.37) MAPTSMN1; SMN2NPC1RAB9ATP53
SCHEMBL17408865 0.66 GRIN2B (0.46) CTSAMAPK1MAP2K4MAPKAPK2MAPKAPK3
SCHEMBL1544615 0.66 NOTUM (0.49) MAPTSMN1; SMN2NPC1RAB9ATP53

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-9920040-B2 GPR40 agonists for the treatment of type II diabetes JANSSEN PHARMACEUTICA NV (BE) 2018-03-20 US disclosed
US-9908873-B2 GPR40 agonists for the treatment of type II diabetes JANSSEN PHARMACEUTICA NV (BE) 2018-03-06 US disclosed
US-9856245-B2 GPR40 agonists for the treatment of type II diabetes JANSSEN PHARMACEUTICA NV (BE) 2018-01-02 US disclosed
US-20170044146-A1 GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN PHARMACEUTICA NV (BE) 2017-02-16 US disclosed
US-20170044148-A1 GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN PHARMACEUTICA NV (BE) 2017-02-16 US disclosed
US-20170044147-A1 GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN PHARMACEUTICA NV (BE) 2017-02-16 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 (3 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-20170044148-A1 GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES GPR119, GPR65, GPR52 KAT6A 3240/4885MAPT 4667/4885SMN1; SMN2 4472/4885
US-20170044146-A1 GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES GPR119, GPR65, GPR52 KAT6A 3849/4885MAPT 4614/4885SMN1; SMN2 4373/4885
US-20170044147-A1 GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES GPR119, GPR55, GPR65 KAT6A 4087/4885MAPT 3978/4885SMN1; SMN2 3732/4885

“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.