SCHEMBL17159047

SCHEMBL17159047

COC(=O)c1cc(C=CC(=O)OC(C)(C)C)n(C)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ XPO1 O14980 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ ESR1 P03372 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ MMP2 P08253 1/20 0.32
▸ MMP13 P45452 1/20 0.32
▸ MMP14 P50281 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ NR1H4 Q96RI1 2/20 0.32
▸ CCR9 P51686 1/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ LMNA P02545 1/20 0.31

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
SCHEMBL17159046 1.00 NPC1 (0.36) NPC1PKMXPO1SMN1; SMN2KDM4E
SCHEMBL15784496 0.75 MAPK1 (0.39) NPC1PKMKDM4EALDH1A1MMP2
SCHEMBL27163039 0.75 MEN1 (0.39) NPC1PKMSMN1; SMN2KDM4EALDH1A1
SCHEMBL13837541 0.74 MAPK1 (0.38) NPC1PKMSMN1; SMN2KDM4EALDH1A1
SCHEMBL25407400 0.72 MAPK14 (0.46) NPC1PKMSMN1; SMN2MMP2MMP13
SCHEMBL20419546 0.72 KDM4E (0.42) NPC1KDM4EALDH1A1MMP2MMP13
SCHEMBL69696 0.70 MEN1 (0.44) NPC1SMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL1187057 0.70 CA12 (0.39) KDM4EALDH1A1ESR1NR1H4LMNA
SCHEMBL1187056 0.70 CA12 (0.39) KDM4EALDH1A1ESR1NR1H4LMNA
SCHEMBL916582 0.69 MAPT (0.40) NPC1SMN1; SMN2KDM4EALDH1A1NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240317733-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2024-09-26 — — US disclosed
US-20210179603-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2021-06-17 — — US disclosed
US-10968213-B2 Cyclopropanamine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-04-06 — — US disclosed
US-20190315735-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2019-10-17 — — US disclosed
US-10414761-B2 Cyclopropanamine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-09-17 — — US disclosed
US-10053456-B2 Cyclopropanamine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-08-21 — — US disclosed
US-20180162853-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2018-06-14 — — US disclosed
US-9920047-B2 Cyclopropanamine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-03-20 — — US disclosed
US-9718814-B2 Cyclopropanamine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-08-01 — — US disclosed
US-9714241-B2 Cyclopropanamine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-07-25 — — US disclosed
US-20170029417-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-02-02 — — US disclosed
US-20170001994-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2017-01-05 — — US disclosed
US-9487511-B2 Cyclopropanamine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-11-08 — — US disclosed
US-20160311808-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2016-10-27 — — US disclosed
US-20160311814-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2016-10-27 — — US disclosed
US-20150291577-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-10-15 — — 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 (12 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-20190315735-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885
US-20160311808-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885
US-20180162853-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885
US-10053456-B2 Cyclopropanamine compound and use thereof KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885
US-20210179603-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885
US-20240317733-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF KDM1A, KDM1B, KDM2A NPC1 1980/4885PKM 248/4885XPO1 4219/4885
US-10968213-B2 Cyclopropanamine compound and use thereof KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885
US-20170001994-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885
US-10414761-B2 Cyclopropanamine compound and use thereof KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885
US-20150291577-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885
US-20170029417-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885
US-20160311814-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF KDM1A, KDM1B, KDM2A NPC1 2011/4885PKM 232/4885XPO1 4258/4885

“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.

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