SCHEMBL15520834

SCHEMBL15520834

CC1CCC(n2ccc3c(Cl)cccc32)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.43
▸ OPRM1 P35372 1/20 0.35
▸ OPRD1 P41143 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ OPRL1 P41146 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ CNR1 P21554 1/20 0.34
▸ SCD O00767 1/20 0.33
▸ GRM7 Q14831 1/20 0.33
▸ TSHR P16473 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2A6 P11509 1/20 0.32
▸ NPY5R Q15761 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ MAPT P10636 2/20 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
SCHEMBL15520368 0.81 SCD (0.47) OPRM1OPRD1OPRK1OPRL1LMNA
SCHEMBL16821922 0.80 HRH3 (0.35) LMNASCDTSHRCYP1A2PIP4K2A
SCHEMBL15520267 0.80 HRH3 (0.35) LMNASCDTSHRCYP1A2PIP4K2A
SCHEMBL16821910 0.78 PIP4K2A (0.33) LMNACNR1TSHRMEN1PKM
SCHEMBL17818945 0.78 LOXL2 (0.47) NOTUMLOXL2
SCHEMBL15520779 0.75 CNR1 (0.37) OPRM1OPRD1OPRK1OPRL1LMNA
SCHEMBL23648384 0.71 OPRM1 (0.36) OPRM1OPRD1OPRK1OPRL1DRD2
SCHEMBL15910593 0.71 ALDH1A1 (0.38) OPRM1OPRD1OPRK1OPRL1LMNA
SCHEMBL15520383 0.69 SCD (0.47) OPRM1OPRD1OPRK1OPRL1LMNA
SCHEMBL11087997 0.68 KDM4E (0.43) OPRM1OPRD1OPRK1OPRL1DRD2

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-20210032202-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF NOVARTIS INSTITUTE FOR TROPICAL DISEASES PTE LTD. (SG) 2021-02-04 — — US disclosed
US-20160355477-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2016-12-08 — — US disclosed
US-9447039-B2 Indole carboxamide derivatives and uses thereof NOVARTIS AG (CH) 2016-09-20 — — US disclosed
EP-2892880-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF Novartis AG (CH) 2015-07-15 — — EP disclosed
US-20150175539-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2015-06-25 — — US disclosed
WO-2014037900-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2014-03-13 — — 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 (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-20150175539-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF TPH1, TPH2, IARS2 NOTUM 2845/4885OPRM1 955/4885OPRD1 472/4885
US-20210032202-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF TPH1, TPH2, IARS2 NOTUM 3039/4885OPRM1 935/4885OPRD1 436/4885
US-20160355477-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF TPH1, TPH2, IARS2 NOTUM 2845/4885OPRM1 955/4885OPRD1 472/4885

“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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