SCHEMBL4149725

SCHEMBL4149725

Cc1ccc2[nH]c3c(c2c1)CCCC3N[C@@H](C)c1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.78
KCNH2 Q12809 1/20 0.78
GAA P10253 1/20 0.58
CASP6 P55212 1/20 0.58
PRMT5 O14744 2/20 0.54
SIRT1 Q96EB6 3/20 0.54
RECQL P46063 1/20 0.50
SIRT2 Q8IXJ6 1/20 0.50
CDC42 P60953 1/20 0.48
RB1 P06400 5/20 0.46
BRD3 Q15059 2/20 0.45
MEN1 O00255 1/20 0.44
GLA P06280 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CDKN1A P38936 1/20 0.44

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
SCHEMBL20537339 1.00 CYP2D6 (0.78) CYP2D6KCNH2GAACASP6PRMT5
SCHEMBL4194153 1.00 CYP2D6 (0.78) CYP2D6KCNH2GAACASP6PRMT5
SCHEMBL4199294 1.00 CYP2D6 (0.78) CYP2D6KCNH2GAACASP6PRMT5
SCHEMBL5461901 1.00 CYP2D6 (0.78) CYP2D6KCNH2GAACASP6PRMT5
SCHEMBL4195673 1.00 CYP2D6 (0.78) CYP2D6KCNH2GAACASP6PRMT5
SCHEMBL4194377 1.00 CYP2D6 (0.78) CYP2D6KCNH2GAACASP6PRMT5
SCHEMBL4172408 1.00 CYP2D6 (0.78) CYP2D6KCNH2GAACASP6PRMT5
SCHEMBL20537338 1.00 CYP2D6 (0.78) CYP2D6KCNH2GAACASP6PRMT5
Hydrochloric Acid SCHEMBL4152184 0.99 CYP2D6 (0.77) CYP2D6KCNH2GAACASP6PRMT5
Hydrochloric Acid SCHEMBL4165920 0.99 CYP2D6 (0.77) CYP2D6KCNH2GAACASP6PRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110914270-B Preparation method of pirlindole enantiomer and salt thereof 社会医疗技术员技术股份公司 2022-05-03 CN claimed
EP-1658068-B1 NOVEL CYCLOALKYL[B] CONDENSED INDOLES SMITHKLINE BEECHAM CORP (US) 2009-02-18 EP claimed
CN-110914270-B Preparation method of pirlindole enantiomer and salt thereof 社会医疗技术员技术股份公司 2022-05-03 CN disclosed
US-20150210717-A1 SPECIFIC INHIBITORS OF PROTEIN P21 AS THERAPEUTIC AGENTS LEIBNIZ-INSTITUT FÜR ALTERSFORSCHUNG (DE) 2015-07-30 US disclosed
US-20150210717-A1 SPECIFIC INHIBITORS OF PROTEIN P21 AS THERAPEUTIC AGENTS LEIBNIZ-INSTITUT FÜR ALTERSFORSCHUNG (DE) 2015-07-30 US disclosed
WO-2014041125-A1 SPECIFIC INHIBITORS OF PROTEIN P21 AS THERAPEUTIC AGENTS BADEN-WÜRTTEMBERG STIFTUNG GMBH (DE) 2014-03-20 WO disclosed
US-7622494-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-11-24 US disclosed
US-7622494-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-11-24 US disclosed
US-7622494-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-11-24 US disclosed
US-20090170923-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 US disclosed
US-20090170923-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 US disclosed
US-20090170923-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 US disclosed
EP-1658068-B1 NOVEL CYCLOALKYL[B] CONDENSED INDOLES SMITHKLINE BEECHAM CORP (US) 2009-02-18 EP disclosed
US-20060281804-A1 Novel cycloalkyl'b! condensed indoles SMITHKLINE BEECHAM CORPORATION 2006-12-14 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-20090170923-A1 HCV INHIBITORS HAVCR2, MAVS, EIF2AK2 CYP2D6 994/4885KCNH2 4356/4885GAA 908/4885
US-20150210717-A1 SPECIFIC INHIBITORS OF PROTEIN P21 AS THERAPEUTIC AGENTS CDKN1A, ING2, BCCIP CYP2D6 4797/4885KCNH2 4759/4885GAA 3655/4885
US-20060281804-A1 Novel cycloalkyl'b! condensed indoles BCCIP, TP53, TOP2B CYP2D6 3945/4885KCNH2 3846/4885GAA 4529/4885

“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.