SCHEMBL17847939

SCHEMBL17847939

CN(C)C(=O)c1ccc(C(Br)=C2CCN(C(=O)O)CC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
OPRD1 P41143 10/20 0.39
OPRK1 P41145 6/20 0.38
OPRM1 P35372 6/20 0.36
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
NPY2R P49146 1/20 0.35
KCNH2 Q12809 1/20 0.34
CYP1A2 P05177 3/20 0.34
TP53 P04637 1/20 0.34
ALOX15 P16050 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP2D6 P10635 2/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
GRIA2 P42262 1/20 0.33
BCL2 P10415 1/20 0.33

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
SCHEMBL474258 0.84 OPRD1 (0.38) ALDH1A1OPRD1OPRK1OPRM1
SCHEMBL19598956 0.81 GPR119 (0.52)
SCHEMBL17847937 0.73 OPRD1 (0.46) OPRD1OPRK1OPRM1KCNH2
SCHEMBL12777868 0.71 SETD7 (0.41) HPGDOPRD1OPRK1OPRM1
SCHEMBL12708214 0.71 OPRD1 (0.69) ALDH1A1HPGDOPRD1OPRK1OPRM1
SCHEMBL17843398 0.70 POLB (0.43) ALDH1A1SMN1; SMN2TSHR
SCHEMBL12432540 0.70 SETD7 (0.47) ALDH1A1HPGDSMN1; SMN2OPRD1TP53
SCHEMBL25253125 0.70 MYC (0.46) ALDH1A1HPGDTP53
SCHEMBL12730808 0.70 OPRD1 (0.53) ALDH1A1HPGDOPRD1OPRK1OPRM1
SCHEMBL29008622 0.70 HDAC6 (0.50) ALDH1A1

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
EP-3233825-B1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES AND THEIR USE AS DELTA OPIOID RECEPTOR AGONISTS PHARMNOVO AB (SE) 2020-04-29 EP disclosed
US-10118921-B2 Diarylmethylidene piperidine derivatives and their use as delta opoid receptor agnists PHARMNOVO AB (SE) 2018-11-06 US disclosed
US-20170327491-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES AND THEIR USE AS DELTA OPOID RECEPTOR AGNISTS PHARMNOVO AB (SE) 2017-11-16 US disclosed
EP-3233825-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES AND THEIR USE AS DELTA OPIOID RECEPTOR AGONISTS Pharmnovo AB (SE) 2017-10-25 EP disclosed
WO-2016099393-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES AND THEIR USE AS DELTA OPIOID RECEPTOR AGONISTS PHARMNOVO AB (SE) 2016-06-23 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-10118921-B2 Diarylmethylidene piperidine derivatives and their use as delta opoid receptor agnists OPRD1, OPRM1, OPRK1 ALDH1A1 716/4885HPGD 562/4885SMN1; SMN2 1863/4885
US-20170327491-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES AND THEIR USE AS DELTA OPOID RECEPTOR AGNISTS OPRD1, OPRM1, OPRK1 ALDH1A1 716/4885HPGD 562/4885SMN1; SMN2 1863/4885

“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.