SCHEMBL20971145

SCHEMBL20971145

O=c1[nH]cnc2c1ccn2-c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ IP6K1 Q92551 1/20 0.56
▸ MAPT P10636 4/20 0.51
▸ MCHR1 Q99705 8/20 0.47
▸ PKM P14618 2/20 0.47
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ KCNH2 Q12809 5/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ CSNK2A2 P19784 1/20 0.43
▸ CSNK2B P67870 1/20 0.43
▸ CSNK2A1 P68400 1/20 0.43
▸ SRC P12931 1/20 0.43
▸ MMP13 P45452 1/20 0.43

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
SCHEMBL20971223 0.88 IP6K1 (0.57) IP6K1MAPTL3MBTL1KCNH2SMN1; SMN2
SCHEMBL20971053 0.83 SRC (0.55) MAPTPKMNPC1RAB9ASMN1; SMN2
SCHEMBL20971135 0.80 MAPT (0.56) MAPTPKMNPC1RAB9ASMN1; SMN2
SCHEMBL29627442 0.78 PARP1 (0.46) IP6K1MAPTPKMSMN1; SMN2SRC
SCHEMBL20971251 0.77 SRC (0.40) IP6K1MAPTPKMSRC
SCHEMBL20971033 0.77 POLB (0.41) MAPTMCHR1PKMNPC1RAB9A
SCHEMBL20971049 0.76 MAPK9 (0.43) IP6K1MAPTPKMNPC1RAB9A
SCHEMBL29627431 0.76 MAPK9 (0.43) IP6K1MAPTPKMNPC1RAB9A
SCHEMBL20971290 0.75 MAPT (0.47) MAPTNPC1RAB9ASRC
SCHEMBL20971305 0.75 MAPT (0.53) MAPTPKMSRC

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-11046681-B2 Substituted piperidines for the treatment of cancer LES LABORATOIRES SERVIER (FR) 2021-06-29 — — US disclosed
US-10654849-B2 (Hetero)aryl-substituted-piperidinyl derivatives, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2020-05-19 — — US disclosed
EP-3468971-B1 NEW (HETERO)ARYL-SUBSTITUTED-PIPERIDINYL DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2020-02-19 — — EP disclosed
EP-3468974-B1 NEW PIPERIDINYL DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2020-02-12 — — EP disclosed
US-20190144449-A1 (HETERO)ARYL-SUBSTITUTED-PIPERIDINYL DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LES LABORATOIRES SERVIER (FR) 2019-05-16 — — US disclosed
US-20190144448-A1 PIPERIDINYL DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM VERNALIS (R&D) LTD (GB) 2019-05-16 — — 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 (4 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-20190144448-A1 PIPERIDINYL DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BAX, BCL2, CASP3 IP6K1 1851/4885MAPT 3150/4885MCHR1 4301/4885
US-11046681-B2 Substituted piperidines for the treatment of cancer BCL2, MCL1, BCL2A1 IP6K1 1871/4885MAPT 4497/4885MCHR1 4105/4885
US-20190144449-A1 (HETERO)ARYL-SUBSTITUTED-PIPERIDINYL DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BAX, BCL2, CCNK IP6K1 1108/4885MAPT 3232/4885MCHR1 4259/4885
US-10654849-B2 (Hetero)aryl-substituted-piperidinyl derivatives, a process for their preparation and pharmaceutical compositions containing them BAX, BCL2, CCNK IP6K1 1108/4885MAPT 3232/4885MCHR1 4259/4885

“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.

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