SCHEMBL2740484

SCHEMBL2740484

Cc1ccccc1C(=O)N1CCN(C(=O)CC(=O)Nc2ccc(-c3ccccc3)cn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
PORCN Q9H237 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
USP30 Q70CQ3 1/20 0.46
TSHR P16473 2/20 0.45
USP2 O75604 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 2/20 0.45
POLB P06746 1/20 0.44
WNT3A P56704 1/20 0.44
LMNA P02545 1/20 0.44
CCR6 P51684 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
SCHEMBL224223 0.88 ALDH1A1 (0.49) PORCNMEN1KMT2AUSP30TSHR
SCHEMBL222682 0.85 SCD (0.48) USP30WNT3A
SCHEMBL221711 0.85 MAPT (0.61) HTTMEN1KMT2AMAPTNPSR1
SCHEMBL2740499 0.80 MAPT (0.52) HTTPORCNMAPTNPSR1TSHR
SCHEMBL2740478 0.80 POLB (0.53) HTTMAPTNPSR1TSHRUSP2
SCHEMBL222965 0.80 ALDH1A1 (0.48) PORCNMEN1KMT2AUSP30TSHR
SCHEMBL2740501 0.76 MAPT (0.61) HTTKMT2AMAPTNPSR1TSHR
SCHEMBL2740472 0.75 HTT (0.67) HTTKMT2AMAPTNPSR1TSHR
SCHEMBL2740487 0.74 MAPT (0.52) HTTMEN1KMT2AMAPTTSHR
SCHEMBL2317227 0.73 ALDH1A1 (0.57) PORCNMEN1KMT2AMAPTUSP30

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-20120004213-A1 NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-CoA DESATURASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2012-01-05 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-20120004213-A1 NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-CoA DESATURASE SCD, SCD5, FADS2 HTT 3358/4885PORCN 124/4885MEN1 4883/4885

“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.