SCHEMBL2994925

SCHEMBL2994925

O=c1cc(-c2ccncc2)[nH][nH]1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.63
GAA P10253 7/20 0.63
KDM4E B2RXH2 6/20 0.63
TDP1 Q9NUW8 4/20 0.63
KMT2A Q03164 4/20 0.59
THRB P10828 4/20 0.59
MEN1 O00255 3/20 0.59
ALDH1A1 P00352 1/20 0.59
TSHR P16473 1/20 0.59
PKM P14618 2/20 0.53
USP2 O75604 1/20 0.50
ALOX12 P18054 1/20 0.50
HTT P42858 1/20 0.50
POLB P06746 1/20 0.49
HSP90AA1 P07900 1/20 0.47
CDC7 O00311 4/20 0.46
PDPK1 O15530 1/20 0.43
GSK3B P49841 2/20 0.42
LMNA P02545 1/20 0.42
PKN1 Q16512 2/20 0.41

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
SCHEMBL3372323 0.77 MAPT (1.00) MAPTGAAKDM4ETDP1KMT2A
SCHEMBL729429 0.75 PIK3CA (0.58) MAPTGAAKDM4EKMT2ATHRB
SCHEMBL16060851 0.75 PDE3B (0.45) MAPTGAAKDM4ETDP1KMT2A
SCHEMBL29514194 0.74 MAPT (1.00) MAPTGAAKDM4ETDP1KMT2A
SCHEMBL6936602 0.72 TAS2R38 (0.68) ALDH1A1CDC7GSK3BPKN1PKN2
SCHEMBL3607976 0.71 MAPT (0.51) MAPTGAAKDM4ETDP1KMT2A
SCHEMBL700288 0.69 MAPT (0.62) MAPTGAAKDM4ETDP1KMT2A
SCHEMBL16600651 0.68 MAPT (0.68) MAPTGAAKDM4ETDP1KMT2A
SCHEMBL694338 0.68 MAPT (0.56) MAPTGAAKDM4ETDP1KMT2A
SCHEMBL11226843 0.68 NOTUM (0.67) MAPTCDC7PDPK1GSK3BLMNA

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-20100184811-A1 ISONIAZID MEDIATED HEALING OF WOUNDS AND ULCERS BRIDGE BIORESEARCH RIGHTS (JERSEY) LIMITED (GB) 2010-07-22 US disclosed
EP-2068873-A2 ISONIAZID MEDIATED HEALING OF WOUNDS AND ULCERS Pharma 2100 (DK) 2009-06-17 EP disclosed
WO-2008031440-A2 ISONIAZID MEDIATED HEALING OF WOUNDS AND ULCERS PHARMA 2100 (DK) 2008-03-20 WO disclosed
US-4526895-A 3-Pyridyl-5-alkoxy-pyrazole derivatives and pharmaceutical composition for use as a cardiotonic medication ETABLISSEMENTS NATIVELLE S.A. (FR) 1985-07-02 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 (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-20100184811-A1 ISONIAZID MEDIATED HEALING OF WOUNDS AND ULCERS ODC1, OTC, ACACB MAPT 2862/4885GAA 3745/4885KDM4E 3169/4885

“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.