SCHEMBL4565978

SCHEMBL4565978

CCCCCc1nsnc1Cl

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.40
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 3/20 0.32
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
KCNH2 Q12809 1/20 0.31
TYMP P19971 3/20 0.31

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
SCHEMBL7213588 0.84 CHRM1 (0.45) CHRM1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL7212322 0.75 CHRM1 (0.40) CHRM1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL8442739 0.67 CHRM1 (0.49) CHRM1KCNH2
SCHEMBL27705339 0.67 ALDH1A1 (0.36) MEN1KMT2AL3MBTL1ALDH1A1TDP1
SCHEMBL14776060 0.67 L3MBTL1 (0.40) MEN1KMT2AL3MBTL1ALDH1A1TDP1
SCHEMBL5450149 0.65 KMT2A (0.36) MEN1KMT2AL3MBTL1ALDH1A1TDP1
SCHEMBL9626275 0.65 TYMP (0.33) MEN1KMT2AL3MBTL1ALDH1A1TDP1
SCHEMBL22623929 0.65 TDP1 (0.39) CHRM1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL21718763 0.64 FDPS (0.33)
SCHEMBL27694884 0.64 SCNN1A (0.40) MEN1KMT2AL3MBTL1ALDH1A1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2620429-A1 Hydroxylamine compounds and methods of their use Colby Pharmaceutical Company (US) 2013-07-31 EP disclosed
EP-2125716-A2 HYDROXYLAMINE COMPOUNDS AND METHODS OF THEIR USE Othera Holding, Inc. (US) 2009-12-02 EP disclosed
EP-2120942-A2 DRUG RESISTANCE REVERSAL IN NEOPLASTIC DISEASE Othera Holding, Inc. (US) 2009-11-25 EP disclosed
US-20080280890-A1 HYDROXYLAMINE COMPOUNDS AND METHODS OF THEIR USE COLBY PHARMACEUTICAL COMPANY 2008-11-13 US disclosed
WO-2008103613-A2 HYDROXYLAMINE COMPOUNDS AND METHODS OF THEIR USE OTHERA HOLDING, INC. (US) 2008-08-28 WO disclosed
US-20080200405-A1 Drug Resistance Reversal In Neoplastic Disease COLBY PHARMACEUTICAL COMPANY 2008-08-21 US disclosed
WO-2008101195-A2 DRUG RESISTANCE REVERSAL IN NEOPLASTIC DISEASE OTHERA HOLDING, INC. (US) 2008-08-21 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 (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-20080280890-A1 HYDROXYLAMINE COMPOUNDS AND METHODS OF THEIR USE HDGF, HMOX1, HMOX2 CHRM1 1406/4885MEN1 2273/4885KMT2A 3795/4885
US-20080200405-A1 Drug Resistance Reversal In Neoplastic Disease VHL, ABCC1, SLC11A2 CHRM1 4209/4885MEN1 569/4885KMT2A 414/4885

“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.