SCHEMBL16600431

SCHEMBL16600431

[CH2]C(=O)N1CC2(CNC(=O)C2)C1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
PDCD1 Q15116 2/20 0.31
CD274 Q9NZQ7 2/20 0.31

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
SCHEMBL16600640 0.84 GRM5 (0.36) CYP11B1CYP11B2CD274
SCHEMBL31175615 0.83 OPRM1 (0.37) SMN1; SMN2CYP11B1CYP11B2OPRM1OPRL1
SCHEMBL16600198 0.82 CYP11B1 (0.41) SMN1; SMN2CYP11B1CYP11B2OPRM1OPRL1
SCHEMBL31622174 0.81 SMN1; SMN2 (0.34) SMN1; SMN2CYP11B1CYP11B2OPRM1OPRL1
SCHEMBL26112063 0.76 LMNA (0.35)
SCHEMBL31580332 0.74 CYP11B1 (0.40) SMN1; SMN2CYP11B1CYP11B2OPRM1OPRL1
SCHEMBL25809394 0.74 TET3 (0.38) CYP11B1CYP11B2
SCHEMBL17925559 0.74 DDB1 (0.42) SMN1; SMN2CYP11B2
SCHEMBL29626701 0.73 CYP11B1 (0.39) SMN1; SMN2CYP11B1CYP11B2OPRM1OPRL1
SCHEMBL23260104 0.72 SMN1; SMN2 (0.39) SMN1; SMN2CYP11B1CYP11B2OPRM1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9850203-B2 Autotaxin inhibitor compounds PHARMAKEA, INC. (US) 2017-12-26 US disclosed
EP-3049405-A1 AUTOTAXIN INHIBITOR COMPOUNDS Pharmakea Inc. (US) 2016-08-03 EP disclosed
US-20160214935-A1 AUTOTAXIN INHIBITOR COMPOUNDS DF 2024 IP ACQUISITION, LLC 2016-07-28 US disclosed
WO-2015048301-A1 AUTOTAXIN INHIBITOR COMPOUNDS PHARMAKEA, INC. (US) 2015-04-02 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-20160214935-A1 AUTOTAXIN INHIBITOR COMPOUNDS ENPP2, SERPINB1, SERPINE1 SMN1; SMN2 2892/4885CYP11B1 4578/4885CYP11B2 4599/4885

“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.