SCHEMBL11943292

SCHEMBL11943292

O=c1c(NCc2cccnc2)c(N2CCN(S(=O)(=O)c3ccccc3Cl)CC2)cnn1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.50
▸ ALDH1A1 P00352 3/20 0.49
▸ DCTPP1 Q9H773 2/20 0.48
▸ LMNA P02545 3/20 0.48
▸ NAMPT P43490 5/20 0.45
▸ GAA P10253 4/20 0.45
▸ NPBWR1 P48145 1/20 0.45
▸ MCHR1 Q99705 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ KMT2A Q03164 4/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ RAB9A P51151 2/20 0.41
▸ APAF1 O14727 1/20 0.41
▸ HK1 P19367 1/20 0.41
▸ HKDC1 Q2TB90 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ HPGD P15428 1/20 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
SCHEMBL11943190 0.90 ALDH1A1 (0.48) MAPTALDH1A1DCTPP1LMNANAMPT
SCHEMBL11943309 0.86 NAMPT (0.52) MAPTALDH1A1DCTPP1LMNANAMPT
SCHEMBL11943222 0.80 DCTPP1 (0.51) MAPTALDH1A1DCTPP1LMNANPBWR1
SCHEMBL11943311 0.78 POLB (0.47) MAPTALDH1A1DCTPP1LMNAGAA
SCHEMBL11943226 0.77 DCTPP1 (0.44) MAPTALDH1A1DCTPP1LMNANAMPT
SCHEMBL11943174 0.76 MAPT (0.49) MAPTALDH1A1DCTPP1SMN1; SMN2POLB
SCHEMBL11943257 0.76 MAPT (0.48) MAPTALDH1A1DCTPP1LMNANAMPT
SCHEMBL11943132 0.75 MAPT (0.46) MAPTALDH1A1DCTPP1LMNAGAA
SCHEMBL13329325 0.74 ALDH1A1 (0.51) MAPTALDH1A1DCTPP1LMNAPKM
SCHEMBL11943181 0.72 NR2F2 (0.47) MAPTALDH1A1DCTPP1LMNAMCHR1

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-8232274-B2 Pyridazinone derivatives useful as glucan synthase inhibitors ALBANY MOLECULAR RESEARCH, INC. (US) 2012-07-31 — — US disclosed
US-8232274-B2 Pyridazinone derivatives useful as glucan synthase inhibitors ALBANY MOLECULAR RESEARCH, INC. (US) 2012-07-31 — — US disclosed
US-20100158992-A1 PIPERAZINE-SUBSTITUTED PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS SCHERING CORPORATION (US) 2010-06-24 — — US disclosed
US-20100158992-A1 PIPERAZINE-SUBSTITUTED PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS SCHERING CORPORATION (US) 2010-06-24 — — US disclosed
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors SCHERING CORPORATION AND ALBANY MOLECULAR RESEARCH, INC. 2009-07-02 — — US disclosed
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors SCHERING CORPORATION AND ALBANY MOLECULAR RESEARCH, INC. 2009-07-02 — — 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 (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-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors MAN2A1, GYS2, MANBA MAPT 2295/4885ALDH1A1 2437/4885DCTPP1 625/4885
US-20100158992-A1 PIPERAZINE-SUBSTITUTED PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS DPM1, GMPS, MAN2A1 MAPT 3651/4885ALDH1A1 2003/4885DCTPP1 209/4885

“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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