SCHEMBL4118545

SCHEMBL4118545

CCOc1ccc(-c2cc(CCl)ccn2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.47
NPC1 O15118 7/20 0.47
KDM4E B2RXH2 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
MAPT P10636 4/20 0.47
NQO1 P15559 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
PKM P14618 2/20 0.43
MITF O75030 1/20 0.43
ALPL P05186 1/20 0.43
ALDH1A1 P00352 4/20 0.42
CYP2D6 P10635 3/20 0.42
CYP2C9 P11712 3/20 0.42
CYP2C19 P33261 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP19A1 P11511 2/20 0.42
HSD17B10 Q99714 2/20 0.41
TP53 P04637 1/20 0.41
MEN1 O00255 1/20 0.41
CYP3A4 P08684 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
SCHEMBL4769299 0.86 NPC1 (0.47) RAB9ANPC1KDM4EMAPTALDH1A1
SCHEMBL4772868 0.80 LOXL2 (0.43) KDM4ESMN1; SMN2MAPTL3MBTL1ALDH1A1
SCHEMBL6703629 0.79 CCR1 (0.53) RAB9ANPC1KDM4ESMN1; SMN2MAPT
SCHEMBL4128508 0.78 MAP4K4 (0.46) RAB9AKDM4ESMN1; SMN2MAPTL3MBTL1
SCHEMBL4117407 0.77 LOXL2 (0.43) RAB9ANPC1KDM4EMAPTL3MBTL1
SCHEMBL4775515 0.77 ASIC3 (0.50) NPC1KDM4EALDH1A1
SCHEMBL4116786 0.76 ASIC3 (0.53) NPC1KDM4ESMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL27602586 0.76 LOXL2 (0.56)
SCHEMBL1681797 0.75 CCR1 (0.42) KDM4ECYP1A2KDM5AKDM4CKDM5B
SCHEMBL29558394 0.75 CCR1 (0.42) KDM4ECYP1A2KDM5AKDM4CKDM5B

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
US-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR KOWA CO., LTD. (JP) 2009-06-04 US disclosed
US-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR KOWA CO., LTD. (JP) 2009-06-04 US disclosed
US-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR KOWA CO., LTD. (JP) 2009-06-04 US disclosed
CN-100406441-C Cyclic amine compounds KOWA CO (JP) 2008-07-30 CN disclosed
US-20060040986-A1 Erythropoietin production accelerator KOWA CO., LTD. (JP) 2006-02-23 US disclosed
EP-1568691-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR Kowa Co., Ltd. (JP) 2005-08-31 EP disclosed
US-20050176764-A1 Medicine for treating cancer KOWA CO., LTD (JP) 2005-08-11 US disclosed
CN-1604893-A Cyclic amine compound KOWA CO (JP) 2005-04-06 CN disclosed
US-6867221-B2 Cyclic amine compounds and pharmaceutical composition containing the same KOWA CO., LTD. (JP) 2005-03-15 US disclosed
EP-1494670-A1 MEDICINE FOR TREATING CANCER Kowa Co., Ltd. (JP) 2005-01-12 EP disclosed
EP-1422219-A1 CYCLIC AMINE COMPOUND Kowa Co., Ltd. (JP) 2004-05-26 EP disclosed
US-20040010147-A1 Cyclic amine compounds and pharmaceutical composition containing the same KOWA CO., LTD. (JP) 2004-01-15 US disclosed
WO-2003086397-A1 MEDICINE FOR TREATING CANCER KOWA CO., LTD. (JP) 2003-10-23 WO disclosed
US-6605620-B1 Such as 4-(N-(4-Methoxyphenyl)-N-(3-(3,4,5-trimethoxy-phenyl)-benzoylamino)-1-((2 -(3,4,5-trimethoxyphenyl)pyridin-4-yl)-methyl)piperidine; treatment and prevention of cell adhesion or infiltration KOWA CO., LTD. (JP) 2003-08-12 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 (4 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-20050176764-A1 Medicine for treating cancer HDAC4, HDAC3, NR4A3 RAB9A 4393/4885NPC1 804/4885KDM4E 446/4885
US-20060040986-A1 Erythropoietin production accelerator EPOR, GHRHR, ARL1 RAB9A 4136/4885NPC1 3842/4885KDM4E 1317/4885
US-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR EPOR, GHRHR, ARL1 RAB9A 4136/4885NPC1 3842/4885KDM4E 1317/4885
US-20040010147-A1 Cyclic amine compounds and pharmaceutical composition containing the same HRH3, HRH4, CNKSR1 RAB9A 2305/4885NPC1 1367/4885KDM4E 3113/4885

“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.