SCHEMBL16485478

SCHEMBL16485478

CC(=O)CC(=O)/C=C/c1ccc2c(c1)OCCO2

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.64
▸ MAPT P10636 7/20 0.57
▸ APP P05067 1/20 0.57
▸ RAB9A P51151 5/20 0.57
▸ NPC1 O15118 3/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.56
▸ ALDH1A1 P00352 1/20 0.55
▸ CXCL12 P48061 1/20 0.54
▸ TRPV1 Q8NER1 5/20 0.54
▸ KMT2A Q03164 4/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ MEN1 O00255 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ MAOB P27338 1/20 0.51
▸ TRPM8 Q7Z2W7 1/20 0.51

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
SCHEMBL17003817 1.00 KDM4E (0.64) KDM4EMAPTAPPRAB9ANPC1
SCHEMBL3209559 0.93 KDM4E (0.73) KDM4EMAPTAPPRAB9ANPC1
SCHEMBL3209529 0.93 KDM4E (0.73) KDM4EMAPTAPPRAB9ANPC1
SCHEMBL3210767 0.86 MAPT (0.71) KDM4EMAPTAPPRAB9ANPC1
SCHEMBL3210786 0.86 MAPT (0.71) KDM4EMAPTAPPRAB9ANPC1
SCHEMBL17691541 0.83 MAPT (0.71) KDM4EMAPTAPPRAB9ANPC1
SCHEMBL10793430 0.83 KDM4E (0.73) KDM4EMAPTRAB9ANPC1NPSR1
SCHEMBL10793426 0.83 KDM4E (0.73) KDM4EMAPTRAB9ANPC1NPSR1
SCHEMBL3211828 0.81 MAPT (0.71) KDM4EMAPTAPPRAB9ANPSR1
SCHEMBL3211852 0.81 MAPT (0.71) KDM4EMAPTAPPRAB9ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2907805-B1 NOVEL PYRAZOLE DERIVATIVE GREEN TECHNOLOGY CO LTD (JP) 2020-07-22 — — EP disclosed
US-9724333-B2 Pyrazole derivative GREEN TECH CO., LTD. (JP) 2017-08-08 — — US disclosed
US-9724333-B2 Pyrazole derivative GREEN TECH CO., LTD. (JP) 2017-08-08 — — US disclosed
US-9724333-B2 Pyrazole derivative GREEN TECH CO., LTD. (JP) 2017-08-08 — — US disclosed
US-20160228412-A1 NOVEL PYRAZOLE DERIVATIVE GREEN TECH CO., LTD. (JP) 2016-08-11 — — US disclosed
US-20160228412-A1 NOVEL PYRAZOLE DERIVATIVE GREEN TECH CO., LTD. (JP) 2016-08-11 — — US disclosed
US-20160228412-A1 NOVEL PYRAZOLE DERIVATIVE GREEN TECH CO., LTD. (JP) 2016-08-11 — — US disclosed
US-9321752-B2 Pyrazole derivative GREEN TECH CO., LTD. (JP) 2016-04-26 — — US disclosed
US-9321752-B2 Pyrazole derivative GREEN TECH CO., LTD. (JP) 2016-04-26 — — US disclosed
US-9321752-B2 Pyrazole derivative GREEN TECH CO., LTD. (JP) 2016-04-26 — — US disclosed
US-20150252029-A1 Novel Pyrazole Derivative GREEN TECH CO., LTD. (JP) 2015-09-10 — — US disclosed
US-20150252029-A1 Novel Pyrazole Derivative GREEN TECH CO., LTD. (JP) 2015-09-10 — — US disclosed
US-20150252029-A1 Novel Pyrazole Derivative GREEN TECH CO., LTD. (JP) 2015-09-10 — — US disclosed
EP-2907805-A1 NOVEL PYRAZOLE DERIVATIVE Green Tech Co., Ltd. (JP) 2015-08-19 — — EP disclosed
WO-2014057772-A1 NOVEL PYRAZOLE DERIVATIVE 株式会社ファルマエイト (JP) 2014-04-17 — — 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 (2 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-20160228412-A1 NOVEL PYRAZOLE DERIVATIVE PSEN2, PSEN1, MAPT KDM4E 4095/4885MAPT 3/4885APP 4/4885
US-20150252029-A1 Novel Pyrazole Derivative PSEN2, PSEN1, MAPT KDM4E 4095/4885MAPT 3/4885APP 4/4885

“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.

Send feedback