SCHEMBL17347951

SCHEMBL17347951

O=c1[nH]c2ccc(-c3cccnc3)cc2c(=O)n1CCC1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.49
▸ DYRK1A Q13627 13/20 0.46
▸ WNT1 P04628 12/20 0.46
▸ ACHE P22303 2/20 0.45
▸ ATM Q13315 2/20 0.44
▸ ATR Q13535 2/20 0.44
▸ METAP2 P50579 1/20 0.42
▸ KCNH2 Q12809 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL17335961 0.89 HPGD (0.49) HPGDDYRK1AWNT1ACHE
SCHEMBL17347729 0.88 HPGD (0.50) HPGDACHEMETAP2
SCHEMBL17335940 0.77 HPGD (0.55) HPGDACHE
SCHEMBL17335984 0.77 HPGD (0.55) HPGDACHE
SCHEMBL10084674 0.76 HPGD (0.53) HPGDACHEMEN1KMT2A
SCHEMBL17335941 0.73 HPGD (0.50) HPGDACHEMEN1KMT2A
SCHEMBL17335950 0.72 ERCC1 (0.58) HPGDACHECYP2D6CYP2C9KMT2A
SCHEMBL17335985 0.72 ATM (0.52) DYRK1AWNT1ATMATRKCNH2
SCHEMBL17335957 0.71 HPGD (0.51) HPGDACHEKMT2A
SCHEMBL17347739 0.71 ERCC1 (0.59) HPGDACHEKMT2A

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-20170114029-A1 TREATMENT OF CHAGAS DISEASE SYNGENE INTERNATIONAL LIMITED (IN) 2017-04-27 — — US disclosed
US-20170114029-A1 TREATMENT OF CHAGAS DISEASE SYNGENE INTERNATIONAL LIMITED (IN) 2017-04-27 — — US disclosed
US-20170114029-A1 TREATMENT OF CHAGAS DISEASE SYNGENE INTERNATIONAL LIMITED (IN) 2017-04-27 — — US disclosed
WO-2015189595-A1 TREATMENT OF CHAGAS DISEASE UNIVERSITY OF DUNDEE (GB) 2015-12-17 — — 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-20170114029-A1 TREATMENT OF CHAGAS DISEASE CXCR4, CBR1, CHRM1 HPGD 3131/4885DYRK1A 1905/4885WNT1 499/4885

“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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