SCHEMBL14684166

SCHEMBL14684166

FC(F)(F)c1cc(-c2cc[nH]n2)cc(C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.40
IKBKB O14920 2/20 0.40
KDM1A O60341 1/20 0.39
RXRA P19793 2/20 0.37
RXRB P28702 2/20 0.37
RXRG P48443 2/20 0.37
F2RL3 Q96RI0 1/20 0.36
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
NOTUM Q6P988 2/20 0.34
MAPK1 P28482 1/20 0.34
MAP2K4 P45985 1/20 0.34
MAPKAPK2 P49137 1/20 0.34
MAPKAPK3 Q16644 1/20 0.34
MAPK6 Q16659 1/20 0.34
TRPA1 O75762 1/20 0.33
KDM4E B2RXH2 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL18051409 0.88 NOTUM (0.48) IDO1IKBKBKDM1ARXRARXRB
SCHEMBL99662 0.84 IDO1 (0.59) IDO1IKBKBKDM1ACTSSCTSK
SCHEMBL1763375 0.82 KIF11 (0.47) IDO1KDM1AF2RL3NOTUMKDM4E
SCHEMBL25538453 0.82 CYP11B2 (0.42) IDO1PIM1
SCHEMBL26128744 0.81 IDO1 (0.33) IDO1IKBKBS1PR1KDM4E
SCHEMBL28313237 0.79
SCHEMBL14326107 0.77 KDM4E (0.35) RXRARXRBRXRGS1PR1S1PR3
SCHEMBL10581858 0.77 IL1B (0.36) NOTUMKDM4ERAB9ASMN1; SMN2
SCHEMBL3366573 0.75 SCN9A (0.46) NOTUM
SCHEMBL16766999 0.71 LMNA (0.36) IDO1NOTUMMAPK1RAB9ASMN1; SMN2

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024175804-A1 NUCLEAR TRANSPORT MODULATORS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2024-08-29 WO disclosed
CN-115197160-A Heterocyclic compounds 武田药品工业株式会社 2022-10-18 CN disclosed
CN-107108506-B Heterocyclic compounds 武田药品工业株式会社 2022-06-21 CN disclosed
US-20210340114-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-11-04 US disclosed
US-20210340114-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-11-04 US disclosed
EP-3848353-A1 MEDICAMENTS FOR THE TREATMENT OF OPHTHALMIC DISEASES Takeda Pharmaceutical Company Limited (JP) 2021-07-14 EP disclosed
US-10975043-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-04-13 US disclosed
US-10975043-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-04-13 US disclosed
EP-3210973-B1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF OPHTHALMIC DISEASES TAKEDA PHARMACEUTICALS CO (JP) 2020-12-02 EP disclosed
US-20200157062-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-05-21 US disclosed
US-10544111-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-01-28 US disclosed
US-10544111-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-01-28 US disclosed
EP-2736883-B1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS INC (US) 2019-09-04 EP disclosed
US-20190119225-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-04-25 US disclosed
US-20190119225-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-04-25 US disclosed
US-20180237404-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-08-23 US disclosed
EP-3210973-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2017-08-30 EP disclosed
US-20170137430-A1 Nuclear Transport Modulators And Uses Thereof KARYOPHARM THERAPEUTICS INC (US) 2017-05-18 US disclosed
US-9428490-B2 Nuclear transport modulators and uses thereof Karyopharm Therapeutics Inc. (US) 2016-08-30 US disclosed
WO-2013019561-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS, INC. (US) 2013-02-07 WO 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 (7 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-20190119225-A1 HETEROCYCLIC COMPOUND RBP4, RBP1, RARA IDO1 4763/4885IKBKB 926/4885KDM1A 3499/4885
US-20170137430-A1 Nuclear Transport Modulators And Uses Thereof XPO1, XPO5, XPOT IDO1 4080/4885IKBKB 236/4885KDM1A 2670/4885
US-20210340114-A1 HETEROCYCLIC COMPOUND RBP4, RBP1, RARA IDO1 4763/4885IKBKB 926/4885KDM1A 3499/4885
US-20180237404-A1 HETEROCYCLIC COMPOUND RBP4, RBP1, RARA IDO1 4763/4885IKBKB 926/4885KDM1A 3499/4885
US-10975043-B2 Heterocyclic compound RBP4, RBP1, RARA IDO1 4763/4885IKBKB 926/4885KDM1A 3499/4885
US-10544111-B2 Heterocyclic compound RBP4, RBP1, RARA IDO1 4763/4885IKBKB 926/4885KDM1A 3499/4885
US-20200157062-A1 HETEROCYCLIC COMPOUND RBP4, RBP1, RARA IDO1 4763/4885IKBKB 926/4885KDM1A 3499/4885

“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.