SCHEMBL2950147

SCHEMBL2950147

CC(NC(=O)c1ccc(O)c(Cl)c1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
CYP1A2 P05177 1/20 0.67
CYP2C9 P11712 1/20 0.67
CYP2C19 P33261 1/20 0.67
GPR139 Q6DWJ6 1/20 0.60
ALDH1A1 P00352 6/20 0.58
LMNA P02545 3/20 0.58
NPC1 O15118 1/20 0.58
KDM4E B2RXH2 1/20 0.56
HPGD P15428 1/20 0.56
HSD17B10 Q99714 1/20 0.56
GAA P10253 2/20 0.55
PKM P14618 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
TAS1R3 Q7RTX0 2/20 0.54
TAS1R1 Q7RTX1 2/20 0.54
MAPK1 P28482 2/20 0.53
ROCK2 O75116 2/20 0.53
RPS6KA5 O75582 1/20 0.53

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
SCHEMBL3755191 1.00 MEN1 (0.67) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL704026 0.82 TAS1R3 (0.79) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL704025 0.82 TAS1R3 (0.79) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL10323215 0.82 MEN1 (0.66) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL5002947 0.82 ALDH1A1 (0.68) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL10324474 0.82 MEN1 (0.66) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL8191196 0.82 MEN1 (0.66) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL5002951 0.82 ALDH1A1 (0.68) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL24803448 0.81 MEN1 (0.61) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL24803440 0.81 MEN1 (0.61) MEN1KMT2ACYP1A2CYP2C9CYP2C19

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
EP-2222160-B1 HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR PHARMAXIS LTD (AU) 2015-03-18 EP disclosed
US-8426587-B2 Haloallylamine inhibitors of SSAO/VAP-1 and uses therefor PHARMAXIS LTD. (AU) 2013-04-23 US disclosed
CN-101917845-A Haloallylamine inhibitors of SSAO/VAP-1 and uses therefor PHARMAXIS LTD 2010-12-15 CN disclosed
US-20100298330-A1 HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR PHARMAXIS LTD. (AU) 2010-11-25 US disclosed
EP-2222160-A2 HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR Pharmaxis Ltd. (AU) 2010-09-01 EP disclosed
WO-2009066152-A2 HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR PHARMAXIS LTD. (US) 2009-05-28 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-20100298330-A1 HALOALLYLAMINE INHIBITORS OF SSAO/VAP-1 AND USES THEREFOR VAPA, SLC6A11, VAPB MEN1 3253/4885KMT2A 3980/4885CYP1A2 1654/4885

“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.