SCHEMBL6607606

SCHEMBL6607606

CCNC(=O)CCC1CCCCC1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.59
HSD11B1 P28845 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
GLA P06280 1/20 0.48
GAA P10253 2/20 0.47
ALDH1A1 P00352 3/20 0.47
NPC1 O15118 2/20 0.46
NFKB1 P19838 1/20 0.46
RAB9A P51151 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
EPHX1 P07099 1/20 0.46
PKM P14618 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL13636416 1.00 HPGD (0.59) HPGDHSD11B1MEN1KMT2ACTSL
SCHEMBL6392805 0.98 HPGD (0.56) HPGDHSD11B1MEN1KMT2ACTSL
SCHEMBL17664591 0.87 FAAH (0.50) HPGDHSD11B1MEN1KMT2AGLA
SCHEMBL8848118 0.85 HPGD (0.56) HPGDHSD11B1MEN1KMT2ACTSL
SCHEMBL8847821 0.82 ALDH1A1 (0.56) HPGDALDH1A1EPHX1
SCHEMBL8847507 0.81 CASP2 (0.56) HPGDALDH1A1EPHX1
SCHEMBL6063246 0.80 CTSL (0.66) HPGDMEN1KMT2ACTSLCTSB
SCHEMBL8847408 0.80 HPGD (0.54) HPGDMEN1KMT2ACTSLCTSB
SCHEMBL5245833 0.80 HPGD (0.63) HPGDMEN1KMT2ACTSLCTSB
SCHEMBL8393928 0.80 HPGD (0.63) HPGDMEN1KMT2ACTSLCTSB

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-20240116910-A1 Heterocycles as WIP1 Inhibitors PMV PHARMACEUTICALS, INC. 2024-04-11 US disclosed
US-20160137639-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2016-05-19 US disclosed
US-20160137639-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2016-05-19 US disclosed
WO-2014065413-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF 日本たばこ産業株式会社 (JP) 2014-05-01 WO disclosed
EP-1444201-A1 2-(3-SULFONYLAMINO-2-OXOPYRROLIDIN-1-YL)PROPANAMIDES AS FACTOR XA INHIBITORS GLAXO GROUP LIMITED (GB) 2004-08-11 EP disclosed
WO-2003043981-A1 2-(3-SULFONYLAMINO-2-OXOPYRROLIDIN-1-YL)PROPANAMIDES AS FACTOR XA INHIBITORS GLAXO GROUP LIMITED (GB) 2003-05-30 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-20240116910-A1 Heterocycles as WIP1 Inhibitors WAPL, WHR1, G3BP1 HPGD 1279/4885HSD11B1 3313/4885MEN1 1607/4885
US-20160137639-A1 TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF CYP3A7, CYP2C19, CYP3A5 HPGD 841/4885HSD11B1 134/4885MEN1 1076/4885

“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.