SCHEMBL7123353

SCHEMBL7123353

CCOC(=O)Cc1c[nH]c2cc(OCc3ccccc3)ccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.62
TRPM8 Q7Z2W7 3/20 0.58
ALDH1A1 P00352 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
HPGD P15428 1/20 0.57
MDH2 P40926 1/20 0.57
ESR1 P03372 1/20 0.52
IMPDH2 P12268 1/20 0.52
PPARG P37231 3/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
LTA4H P09960 2/20 0.51
PLA2G2A P14555 2/20 0.51
HSP90AA1 P07900 1/20 0.51
HSP90AB1 P08238 1/20 0.51
PPARD Q03181 1/20 0.51
PPARA Q07869 1/20 0.51
HTR1D P28221 3/20 0.49
PRMT5 O14744 2/20 0.49
MAPT P10636 2/20 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
SCHEMBL6219226 0.91 TRPM8 (0.70) PKMTRPM8PPARGMEN1KMT2A
SCHEMBL6664147 0.89 ALDH1A1 (0.60) TRPM8ALDH1A1SMN1; SMN2HPGDMDH2
SCHEMBL4473938 0.86 ALDH1A1 (0.65) TRPM8ALDH1A1SMN1; SMN2HPGDMDH2
SCHEMBL9950019 0.84 ALDH1A1 (0.62) TRPM8ALDH1A1SMN1; SMN2HPGDMDH2
SCHEMBL8171524 0.84 PKM (0.61) PKMALDH1A1SMN1; SMN2PPARGMEN1
SCHEMBL2811774 0.82 ALDH1A1 (0.66) TRPM8ALDH1A1SMN1; SMN2HPGDMDH2
SCHEMBL11747866 0.81 TRPM8 (0.67) TRPM8PPARGMEN1KMT2ALTA4H
SCHEMBL28745968 0.80 ALDH1A1 (0.58) TRPM8ALDH1A1SMN1; SMN2HPGDMDH2
SCHEMBL24815324 0.80 PKM (0.56) PKMALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL4486238 0.80 ALDH1A1 (0.64) TRPM8ALDH1A1SMN1; SMN2HPGDMDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090047246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2009-02-19 US disclosed
WO-2004089915-A1 PIPERAZINE DERIVATIVE RENIN INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-10-21 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 (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-20090047246-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION EIF2AK2, HAVCR2, HCCS PKM 2067/4885TRPM8 4661/4885ALDH1A1 1836/4885

“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.