SCHEMBL15712185

SCHEMBL15712185

O=c1cnc2cc([N+](=O)[O-])ccc2n1-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.61
▸ FGFR1 P11362 2/20 0.51
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ HPGD P15428 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ MPI P34949 1/20 0.49
▸ APOBEC3G Q9HC16 1/20 0.49
▸ MAPT P10636 3/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ HTT P42858 1/20 0.47
▸ MAPK1 P28482 1/20 0.46
▸ POLB P06746 1/20 0.44
▸ ATM Q13315 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
SCHEMBL30807014 0.78 PKM (0.55) ALDH1A1MEN1KMT2APKMRAB9A
SCHEMBL15712465 0.77 ALDH1A1 (0.56) ALDH1A1FGFR1MEN1KMT2AMAPT
SCHEMBL28337580 0.77 ALDH1A1 (0.52) ALDH1A1MEN1KMT2AHPGDPKM
SCHEMBL6234925 0.77 ALDH1A1 (0.56) ALDH1A1FGFR1MEN1KMT2AHPGD
SCHEMBL17505181 0.76 ALDH1A1 (0.52) ALDH1A1FGFR1MEN1KMT2AHPGD
SCHEMBL3342620 0.76 ALDH1A1 (1.00) ALDH1A1FGFR1HPGDPKMMAPT
SCHEMBL29116234 0.76 ALDH1A1 (0.52) ALDH1A1FGFR1MEN1KMT2AHPGD
SCHEMBL30050771 0.76 ALDH1A1 (0.53) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL10944497 0.76 ALDH1A1 (0.53) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL6258346 0.74 ALDH1A1 (0.52) ALDH1A1FGFR1MEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2915804-B1 NOVEL AMINE DERIVATIVE OR SALT THEREOF AS TNF ALPHA INHIBITORS FUJIFILM TOYAMA CHEMICAL CO LTD (JP) 2019-03-27 — — EP disclosed
US-9624215-B2 Amine derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2017-04-18 — — US disclosed
US-9624215-B2 Amine derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2017-04-18 — — US disclosed
US-9624215-B2 Amine derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2017-04-18 — — US disclosed
US-20150299189-A1 NOVEL AMINE DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2015-10-22 — — US disclosed
US-20150299189-A1 NOVEL AMINE DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2015-10-22 — — US disclosed
US-20150299189-A1 NOVEL AMINE DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2015-10-22 — — US disclosed
EP-2915804-A1 NOVEL AMINE DERIVATIVE OR SALT THEREOF Toyama Chemical Co., Ltd. (JP) 2015-09-09 — — EP disclosed
EP-2915804-A1 NOVEL AMINE DERIVATIVE OR SALT THEREOF Toyama Chemical Co., Ltd. (JP) 2015-09-09 — — EP disclosed
WO-2014069510-A1 NOVEL AMINE DERIVATIVE OR SALT THEREOF 富山化学工業株式会社 (JP) 2014-05-08 — — 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 (1 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-20150299189-A1 NOVEL AMINE DERIVATIVE OR SALT THEREOF HRH4, CLIC4, KRT18 ALDH1A1 1842/4885FGFR1 251/4885MEN1 3900/4885

“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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