SCHEMBL16166371

SCHEMBL16166371

CC(=O)Cc1cc(C#N)c2c(c1)CCN2CCBr

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
AR P10275 2/20 0.31
TP53 P04637 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 1/20 0.30
S1PR1 P21453 1/20 0.30

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
SCHEMBL16166135 0.93 CYP11B2 (0.33) CYP11B2MEN1KMT2AARS1PR1
SCHEMBL15649948 0.88 CYP11B2 (0.34) CYP11B2MEN1KMT2ATP53KDM4E
SCHEMBL16166144 0.86 CYP11B2 (0.33) CYP11B2MEN1KMT2AARKDM4E
SCHEMBL15694716 0.84 KMT2A (0.36) CYP11B2MEN1KMT2ATP53KDM4E
SCHEMBL10080603 0.82 SOAT1 (0.33) KDM4EALDH1A1MAPK1S1PR1
SCHEMBL3342398 0.78 TEAD3 (0.39) MEN1KMT2AKDM4EALDH1A1
SCHEMBL12816036 0.78 SCN1A (0.42) MEN1KMT2ATP53KDM4EALDH1A1
SCHEMBL18157054 0.76 MEN1 (0.39) MEN1KMT2A
SCHEMBL18882502 0.73 ALDH1A1 (0.39) MEN1KMT2ATP53KDM4EALDH1A1
SCHEMBL31513757 0.71 KDM4E (0.35) MEN1KMT2AARKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2984070-B1 N-HALOALKYLINDOLINE INTERMEDIATES, THEIR PROCESS AND USE IN PREPARATION OF SILODOSIN AND ITS DERIVATIVES MANKIND PHARMA LTD (IN) 2018-01-17 EP claimed
US-9862681-B2 N-haloalkylindoline intermediates, their process and use in preparation of Silodosin and its derivatives MANKIND RESEARCH CENTRE (IN) 2018-01-09 US claimed
US-20160046577-A1 N-Haloalkylindoline Intermediates, Their Process And Use In Preparation of Silodosin And its Derivatives MANKIND PHARMA LTD (IN) 2016-02-18 US claimed
EP-2984070-A1 N-HALOALKYLINDOLINE INTERMEDIATES, THEIR PROCESS AND USE IN PREPARATION OF SILODOSIN AND ITS DERIVATIVES Mankind Research Centre (IN) 2016-02-17 EP claimed
WO-2014167507-A1 N-HALOALKYLINDOLINE INTERMEDIATES, THEIR PROCESS AND USE IN PREPARATION OF SILODOSIN AND ITS DERIVATIVES MANKIND RESEARCH CENTRE (IN) 2014-10-16 WO claimed
US-10239833-B2 Intermediates, their process and use in preparation of selective α1-adrenoceptor antagonists, Silodosin MANKIND PHARMA LTD. (IN) 2019-03-26 US disclosed
US-20180111901-A1 Novel Intermediates, their Process And Use In Preparation of Selective a1-Adrenoceptor Antagonists, Silodosin MANKIND PHARMA LTD. (IN) 2018-04-26 US disclosed
EP-2984070-B1 N-HALOALKYLINDOLINE INTERMEDIATES, THEIR PROCESS AND USE IN PREPARATION OF SILODOSIN AND ITS DERIVATIVES MANKIND PHARMA LTD (IN) 2018-01-17 EP disclosed
US-9862681-B2 N-haloalkylindoline intermediates, their process and use in preparation of Silodosin and its derivatives MANKIND RESEARCH CENTRE (IN) 2018-01-09 US disclosed
US-20160046577-A1 N-Haloalkylindoline Intermediates, Their Process And Use In Preparation of Silodosin And its Derivatives MANKIND PHARMA LTD (IN) 2016-02-18 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 (3 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-10239833-B2 Intermediates, their process and use in preparation of selective α1-adrenoceptor antagonists, Silodosin ADRA1D, ADRB1, ADRA1A CYP11B2 71/4885MEN1 2109/4885KMT2A 3333/4885
US-20160046577-A1 N-Haloalkylindoline Intermediates, Their Process And Use In Preparation of Silodosin And its Derivatives ADRA1D, ADRA1A, ADRB1 CYP11B2 534/4885MEN1 2015/4885KMT2A 3543/4885
US-20180111901-A1 Novel Intermediates, their Process And Use In Preparation of Selective a1-Adrenoceptor Antagonists, Silodosin ADRA1D, ADRA1A, ADRB1 CYP11B2 87/4885MEN1 1463/4885KMT2A 3310/4885

“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.