SCHEMBL4885809

SCHEMBL4885809

Cc1ccc(N2CCCCC2)c(C)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.68
ALDH1A1 P00352 5/20 0.68
MCOLN3 Q8TDD5 1/20 0.68
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
GAA P10253 2/20 0.61
THRB P10828 1/20 0.61
NR4A1 P22736 1/20 0.61
PTK2B Q14289 1/20 0.61
ALDH1A3 P47895 2/20 0.61
HTT P42858 4/20 0.51
POLB P06746 2/20 0.51
LMNA P02545 4/20 0.49
TP53 P04637 2/20 0.49
RAB9A P51151 2/20 0.49
RECQL P46063 1/20 0.49
PAX8 Q06710 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CRHBP P24387 1/20 0.49
CRHR2 Q13324 1/20 0.49

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
SCHEMBL9832991 0.98 ALDH1A1 (0.65) MAPTALDH1A1MCOLN3MEN1KMT2A
SCHEMBL22839748 0.94 ALDH1A1 (0.60) MAPTALDH1A1MCOLN3MEN1KMT2A
SCHEMBL14504494 0.89 ALDH1A1 (0.61) MAPTALDH1A1MCOLN3MEN1KMT2A
SCHEMBL15872025 0.83 ALDH1A1 (0.55) MAPTALDH1A1MCOLN3MEN1KMT2A
SCHEMBL16727174 0.83 SLC18A3 (0.55) MAPTALDH1A1MCOLN3MEN1KMT2A
SCHEMBL24123854 0.83 ALDH1A1 (0.55) MAPTALDH1A1MCOLN3MEN1KMT2A
SCHEMBL7931333 0.82 HTR3A (0.61) MAPTALDH1A1MCOLN3MEN1KMT2A
SCHEMBL2092264 0.82 MAPT (0.50) MAPTALDH1A1MCOLN3MEN1KMT2A
SCHEMBL19439047 0.82 ALDH1A1 (1.00) MAPTALDH1A1MCOLN3MEN1KMT2A
SCHEMBL29370460 0.82 ALDH1A1 (1.00) MAPTALDH1A1MCOLN3MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4126840-A1 ARYL PIPERIDINES AS MONOACYLGLYCEROL LIPASE MODULATORS Janssen Pharmaceutica NV (BE) 2023-02-08 EP disclosed
US-10669473-B2 Organic molecules for use in optoelectronic components CYNORA GMBH (DE) 2020-06-02 US disclosed
US-20110201608-A1 SUBSTITUTED NAPHTHYRIDINES AND USE THEREOF AS MEDICINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-18 US disclosed
US-7671058-B2 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-03-02 US disclosed
US-7671058-B2 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-03-02 US disclosed
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-09-18 US disclosed
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-09-18 US disclosed
WO-2008004127-A2 METHOD FOR ADMINISTERING TOLPERISONE SANOCHEMIA PHARMAZEUTIKA AG (US) 2008-01-10 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-20110201608-A1 SUBSTITUTED NAPHTHYRIDINES AND USE THEREOF AS MEDICINES NR4A1, NR4A3, NR0B1 MAPT 4405/4885ALDH1A1 1585/4885MCOLN3 1197/4885
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives STAT6, RELA, NFKB2 MAPT 4713/4885ALDH1A1 2263/4885MCOLN3 1163/4885

“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.