SCHEMBL18135560

SCHEMBL18135560

Cc1cc(CNC(=O)C2CCN(c3nc(N)n[nH]3)CC2)c(C)o1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ GAA P10253 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ RET P07949 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ RXFP1 Q9HBX9 2/20 0.39
▸ EPHX2 P34913 2/20 0.39

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
SCHEMBL16825822 0.88 EPHX2 (0.43) LMNAKDM4ERXFP1EPHX2
SCHEMBL16825726 0.82 LMNA (0.52) LMNAKDM4EPOLBMAPTSMN1; SMN2
SCHEMBL18135562 0.80 LMNA (0.63) LMNAKDM4EPOLBMAPTRET
SCHEMBL18135561 0.79 POLB (0.60) LMNAPOLBMAPTSMN1; SMN2ALDH1A1
SCHEMBL16825929 0.79 KDM4E (0.57) LMNAKDM4EMAPTHPGDGAA
SCHEMBL16826017 0.78 KDM4E (0.46) LMNAKDM4EPOLBMAPTSMN1; SMN2
SCHEMBL16825684 0.78 KDM4E (0.61) LMNAKDM4EPOLBMAPTHSD17B10
SCHEMBL16825942 0.78 POLB (0.63) LMNAPOLBMAPTHPGDALDH1A1
SCHEMBL16826434 0.77 MAPT (0.59) LMNAKDM4EPOLBMAPTHPGD
SCHEMBL18135566 0.77 TSHR (0.52) LMNAMAPTRXFP1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160297823-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME INSTITUTE FOR DRUG DISCOVERY, LLC 2016-10-13 — — 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 (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-20160297823-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME CMA1, CHIA, AADAC LMNA 3856/4885KDM4E 2405/4885POLB 3344/4885

“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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