SCHEMBL18940385

SCHEMBL18940385

O=[N+]([O-])c1cn(Cc2cccc(C(F)(F)F)c2)cn1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.54
ALDH1A1 P00352 2/20 0.53
PKM P14618 1/20 0.53
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SLC29A1 Q99808 1/20 0.46
CYP19A1 P11511 2/20 0.45
TAAR1 Q96RJ0 1/20 0.44
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
POLB P06746 1/20 0.43
LMNA P02545 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL18961327 0.81 ALDH1A1 (0.59) ALDH1A1PKMTAAR1GAALMNA
SCHEMBL18961342 0.81 ALDH1A1 (0.56) KDM4CALDH1A1PKMSLC29A1TAAR1
SCHEMBL2979131 0.80 TAAR1 (0.59) KDM4CALDH1A1PKMTAAR1LMNA
SCHEMBL22619912 0.79 ALDH1A1 (0.44) ALDH1A1PKMMEN1KMT2ATAAR1
SCHEMBL15707369 0.78 KDM4C (0.56) KDM4CALDH1A1TAAR1KDM4EGAA
SCHEMBL18971775 0.78 KDM4C (0.56) KDM4CALDH1A1TAAR1KDM4EGAA
SCHEMBL11044543 0.78 ALDH1A1 (0.53) KDM4CALDH1A1PKMTAAR1LMNA
SCHEMBL28210263 0.77 KDM4C (0.56) KDM4CALDH1A1KDM4EGAAPOLB
Hydrochloric Acid SCHEMBL18940405 0.76 KDM4C (0.55) KDM4CALDH1A1TAAR1KDM4EGAA
SCHEMBL21314979 0.76 KDM4C (0.67) KDM4CALDH1A1KDM4EGAACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11661397-B2 1,4-disubstituted imidazole derivative Sumitomo Pharma Co., Ltd. (JP) 2023-05-30 US disclosed
US-11661397-B2 1,4-disubstituted imidazole derivative Sumitomo Pharma Co., Ltd. (JP) 2023-05-30 US disclosed
US-20210171440-A1 1,4-DISUBSTITUTED IMIDAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2021-06-10 US disclosed
US-20210171440-A1 1,4-DISUBSTITUTED IMIDAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2021-06-10 US disclosed
CN-107922386-B 1, 4-disubstituted imidazole derivatives 大日本住友制药株式会社 2021-04-02 CN disclosed
US-10807945-B2 1,4-disubstituted imidazole derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-10-20 US disclosed
US-10807945-B2 1,4-disubstituted imidazole derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-10-20 US disclosed
US-10294237-B2 Bicyclic heterocyclic amide derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2019-05-21 US disclosed
US-10294237-B2 Bicyclic heterocyclic amide derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2019-05-21 US disclosed
US-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-07-12 US disclosed
US-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-07-12 US disclosed
EP-3323809-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2018-05-23 EP disclosed
EP-3312170-A1 1,4-DI-SUBSTITUTED IMIDAZOLE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2018-04-25 EP disclosed
CN-107922386-A 1,4 disubstituted imidazolium derivatives 大日本住友制药株式会社 2018-04-17 CN disclosed
CN-107922348-A Bicyclic heterocyclic amide derivatives 大日本住友制药株式会社 2018-04-17 CN disclosed
US-9828362-B2 1,4-disubstituted imidazole derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-11-28 US disclosed
US-9828362-B2 1,4-disubstituted imidazole derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-11-28 US disclosed
US-20170166552-A1 1,4-DISUBSTITUTED IMIDAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2017-06-15 US disclosed
US-20170166552-A1 1,4-DISUBSTITUTED IMIDAZOLE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2017-06-15 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 (6 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-20170166552-A1 1,4-DISUBSTITUTED IMIDAZOLE DERIVATIVE NR4A3, NR0B1, NR2C2 KDM4C 775/4885ALDH1A1 278/4885PKM 4867/4885
US-10294237-B2 Bicyclic heterocyclic amide derivative NR0B1, NR2E1, NR0B2 KDM4C 1041/4885ALDH1A1 625/4885PKM 4773/4885
US-20210171440-A1 1,4-DISUBSTITUTED IMIDAZOLE DERIVATIVE NR4A3, NR0B1, NR2C2 KDM4C 775/4885ALDH1A1 278/4885PKM 4867/4885
US-11661397-B2 1,4-disubstituted imidazole derivative NR4A3, NR0B1, NR2C2 KDM4C 775/4885ALDH1A1 278/4885PKM 4867/4885
US-10807945-B2 1,4-disubstituted imidazole derivative NR0B1, NR4A3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 KDM4C 773/4885ALDH1A1 258/4885PKM 4838/4885
US-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE NR0B1, NR2E1, NR0B2 KDM4C 1041/4885ALDH1A1 625/4885PKM 4773/4885

“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.