SCHEMBL228123

SCHEMBL228123

O=C(CCl)N1CCN(C(=O)OCc2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62
SMN1; SMN2 Q16637 5/20 0.61
RAB9A P51151 5/20 0.61
NPC1 O15118 4/20 0.61
CYP2C19 P33261 1/20 0.58
ALDH1A1 P00352 3/20 0.57
HTT P42858 2/20 0.57
POLB P06746 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.56
DPP4 P27487 1/20 0.49
GRIN2B Q13224 2/20 0.49
GRM5 P41594 2/20 0.49
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48

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
SCHEMBL3970912 0.89 MEN1 (0.76) MEN1KMT2ANPSR1SMN1; SMN2RAB9A
SCHEMBL7393652 0.89 MEN1 (0.76) MEN1KMT2ANPSR1SMN1; SMN2RAB9A
SCHEMBL4814264 0.89 MEN1 (0.76) MEN1KMT2ANPSR1SMN1; SMN2RAB9A
SCHEMBL379160 0.89 MEN1 (0.76) MEN1KMT2ANPSR1SMN1; SMN2RAB9A
Bicarbonate SCHEMBL4357688 0.87 MEN1 (0.73) MEN1KMT2ANPSR1SMN1; SMN2RAB9A
SCHEMBL15011579 0.87 MEN1 (0.73) MEN1KMT2ANPSR1SMN1; SMN2RAB9A
SCHEMBL15447435 0.86 MEN1 (0.64) MEN1KMT2ANPSR1SMN1; SMN2RAB9A
SCHEMBL6388570 0.85 MEN1 (0.62) MEN1KMT2ANPSR1SMN1; SMN2RAB9A
SCHEMBL8989897 0.85 MEN1 (0.62) MEN1KMT2ANPSR1SMN1; SMN2RAB9A
SCHEMBL15709327 0.85 L3MBTL1 (0.63) MEN1KMT2ANPSR1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230052017-A1 New compounds for treatment of diseases related to DUX4 expression Facio Intellectual Property B.V. (NL) 2023-02-16 US disclosed
EP-4065107-A1 NEW COMPOUNDS FOR TREATMENT OF DISEASES RELATED TO DUX4 EXPRESSION Facio Intellectual Property B.V. (NL) 2022-10-05 EP disclosed
CN-115151256-A Novel compounds for the treatment of diseases associated with DUX expression FACIO知识产权有限公司 2022-10-04 CN disclosed
WO-2021105474-A1 NEW COMPOUNDS FOR TREATMENT OF DISEASES RELATED TO DUX4 EXPRESSION Facio Intellectual Property B.V. (NL) 2021-06-03 WO disclosed
EP-1577288-B1 Selective estrogen receptor modulators EISAI R&D MAN CO LTD (JP) 2014-07-23 EP disclosed
EP-2452939-B1 PIPERAZINYL 3-AMINOPYRROLIDINE DERIVATIVES AS A CCR2 ANTAGONIST YANG JI CHEMICAL CO LTD (KR) 2014-03-26 EP disclosed
US-8575173-B2 Piperazinyl 3-aminopyrrolidine derivatives as a CCR2 antagonists YANG JI CHEMICAL CO., LTD. (KR) 2013-11-05 US disclosed
US-8399520-B2 Selective estrogen receptor modulator EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-03-19 US disclosed
US-20120190689-A1 PIPERAZINYL 3-AMINOPYRROLIDINE DERIVATIVES AS A CCR2 ANTAGONIST YANG JI CHEMICAL CO., LTD. (KR) 2012-07-26 US disclosed
EP-2452939-A2 PIPERAZINYL 3-AMINOPYRROLIDINE DERIVATIVES AS A CCR2 ANTAGONIST Yang Ji Chemical Co., Ltd. (KR) 2012-05-16 EP disclosed
US-20120004315-A1 Selective Estrogen Receptor Modulator RADIUS HEALTH, INC. 2012-01-05 US disclosed
US-7960412-B2 Selective estrogen receptor modulator EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-06-14 US disclosed
US-20090325930-A1 SELECTIVE ESTROGEN RECEPTOR MODULATOR RADIUS HEALTH, INC. 2009-12-31 US disclosed
US-7612114-B2 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-11-03 US disclosed
US-20060116364-A1 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer EISAI CO., LTD. (JP) 2006-06-01 US disclosed
EP-1577288-A1 SELECTIVE ESTROGEN RECEPTOR MODULATORS Eisai Co., Ltd. (JP) 2005-09-21 EP disclosed
US-5922868-A 1-(4,4-ETHYLENEDIOXY-3-METHYLPENTYL)-3-METHYL-7-PROPYLXANTHINE HOECHST AKTIENGESELLSCHAFT (DE) 1999-07-13 US disclosed
EP-0570831-A2 Use of Xanthinderivatives for treatment of cerebral nerve dammages after disruption of the blood circulation HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-24 EP 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 (5 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-20090325930-A1 SELECTIVE ESTROGEN RECEPTOR MODULATOR ESR1, GPER1, ESR2 MEN1 2262/4885KMT2A 371/4885NPSR1 682/4885
US-20120190689-A1 PIPERAZINYL 3-AMINOPYRROLIDINE DERIVATIVES AS A CCR2 ANTAGONIST CCR2, CCR1, CCR9 MEN1 3798/4885KMT2A 1789/4885NPSR1 220/4885
US-20060116364-A1 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer BRCA1, BCR, RCC1 MEN1 231/4885KMT2A 216/4885NPSR1 2906/4885
US-20230052017-A1 New compounds for treatment of diseases related to DUX4 expression SMN1; SMN2, UTRN, DDX21 MEN1 4112/4885KMT2A 1389/4885NPSR1 4217/4885
US-20120004315-A1 Selective Estrogen Receptor Modulator ESR1, GPER1, ESR2 MEN1 2539/4885KMT2A 455/4885NPSR1 555/4885

“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.