SCHEMBL3707215

SCHEMBL3707215

CCC(C)[C@H](N)C(=O)NCCCn1cnnn1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TERT O14746 1/20 0.36
TP53 P04637 4/20 0.35
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HTR4 Q13639 1/20 0.34
USP2 O75604 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
SCHEMBL3704588 0.96 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATERTTP53
SCHEMBL3699910 0.92 ALDH1A1 (0.40) ALDH1A1MEN1KMT2ATERTTP53
SCHEMBL19755642 0.76 ALDH1A1 (0.48) ALDH1A1MEN1KMT2ATP53MAPT
SCHEMBL3702828 0.75 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ATP53MAPT
SCHEMBL10448381 0.74 DPP7 (0.51) TERTUSP2
SCHEMBL3666176 0.73 PTGS1 (0.45) ALDH1A1MEN1KMT2ATERTDPP4
SCHEMBL3697682 0.72 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ATP53MAPT
SCHEMBL3707214 0.72 ALDH1A1 (0.35) ALDH1A1MEN1KMT2ATP53MAPT
SCHEMBL3665407 0.71 DPP7 (0.45) ALDH1A1TERTDPP4DPP8DPP9
SCHEMBL14593722 0.71 DPP7 (0.57)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170783-A1 NOVEL TETRAHYDROCARBAZOLE DERIVATIVES AS LIGANDS OF G-PROTEIN COUPLED RECEPTORS AETERNA ZENTARIS GMBH (DE) 2009-07-02 US claimed
US-8541462-B2 Tetrahydrocarbazole derivatives as ligands of G-protein coupled receptors AETERNA ZENTARIS GMBH (DE) 2013-09-24 US disclosed
US-20120122763-A1 NOVEL TETRAHYDROCARBAZOLE DERIVATIVES AS LIGANDS OF G-PROTEIN COUPLED RECEPTORS AETERNA ZENTARIS GMBH (DE) 2012-05-17 US disclosed
US-20090170783-A1 NOVEL TETRAHYDROCARBAZOLE DERIVATIVES AS LIGANDS OF G-PROTEIN COUPLED RECEPTORS AETERNA ZENTARIS GMBH (DE) 2009-07-02 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 (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-20090170783-A1 NOVEL TETRAHYDROCARBAZOLE DERIVATIVES AS LIGANDS OF G-PROTEIN COUPLED RECEPTORS GPR88, GPR34, GPR27 ALDH1A1 1733/4885MEN1 4290/4885KMT2A 4477/4885
US-20120122763-A1 NOVEL TETRAHYDROCARBAZOLE DERIVATIVES AS LIGANDS OF G-PROTEIN COUPLED RECEPTORS GPR88, GPR34, GPR27 ALDH1A1 1733/4885MEN1 4290/4885KMT2A 4477/4885

“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.