SCHEMBL10169301

SCHEMBL10169301

CC(C)c1ccc(N2CCN(C3CCC3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 7/20 0.53
L3MBTL3 Q96JM7 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
KMT2A Q03164 2/20 0.50
SIGMAR1 Q99720 1/20 0.50
HRH3 Q9Y5N1 1/20 0.46
GRIN2B Q13224 1/20 0.45
MBTD1 Q05BQ5 1/20 0.45
MEN1 O00255 1/20 0.44
KDM4E B2RXH2 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 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
SCHEMBL21026598 0.97 SIGMAR1 (0.53) KDM2BL3MBTL3L3MBTL1KMT2ASIGMAR1
SCHEMBL14923973 0.95 SIGMAR1 (0.55) KDM2BL3MBTL3L3MBTL1KMT2ASIGMAR1
SCHEMBL10169300 0.93 KMT2A (0.53) KDM2BL3MBTL3L3MBTL1KMT2ASIGMAR1
SCHEMBL14923967 0.87 KMT2A (0.51) KDM2BL3MBTL3L3MBTL1KMT2ASIGMAR1
SCHEMBL17660589 0.87 L3MBTL1 (0.48) KDM2BL3MBTL3L3MBTL1KMT2ASIGMAR1
SCHEMBL24123752 0.87 L3MBTL3 (0.68) KDM2BL3MBTL3L3MBTL1KMT2AHRH3
SCHEMBL14924004 0.87 L3MBTL3 (0.73) KDM2BL3MBTL3L3MBTL1KMT2AHRH3
SCHEMBL25897977 0.86 HRH3 (0.52) KDM2BL3MBTL3L3MBTL1KMT2ASIGMAR1
SCHEMBL23328568 0.86 HRH3 (0.52) KDM2BL3MBTL3L3MBTL1KMT2ASIGMAR1
SCHEMBL21731334 0.86 KMT2A (0.47) KDM2BL3MBTL3L3MBTL1KMT2ASIGMAR1

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
US-10934303-B2 Aryl ethene derivative and pharmaceutical composition containing same as active ingredient DAEGU-GYEONGBUK MEDICAL INNOVATION FOUNDATION (KR) 2021-03-02 US disclosed
US-20190167820-A1 NOVEL ARYL ETHENE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT HWANG SUNG YEOUN (KR) 2019-06-06 US disclosed
US-20190161490-A1 NOVEL ARYL ETHENE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT NOVMETAPHARMA CO., LTD. (KR) 2019-05-30 US disclosed
US-8586751-B2 Nicotinamide compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2013-11-19 US disclosed
US-20120082702-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MEYERS SQUIBB COMPANY 2012-04-05 US disclosed
US-20120082702-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MEYERS SQUIBB COMPANY 2012-04-05 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-20190167820-A1 NOVEL ARYL ETHENE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT ESRRG, ESR2, ESR1 KDM2B 1072/4885L3MBTL3 4884/4885L3MBTL1 4883/4885
US-20120082702-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS NADK, BTK, NAMPT KDM2B 2480/4885L3MBTL3 4851/4885L3MBTL1 4514/4885
US-20190161490-A1 NOVEL ARYL ETHENE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT ESRRG, ESR2, ESR1 KDM2B 1072/4885L3MBTL3 4884/4885L3MBTL1 4883/4885
US-10934303-B2 Aryl ethene derivative and pharmaceutical composition containing same as active ingredient ESRRG, ESR1, ESR2 KDM2B 1160/4885L3MBTL3 4884/4885L3MBTL1 4883/4885

“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.