SCHEMBL368694

SCHEMBL368694

CCCC(N)Cc1ccc(/N=N/c2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.47
SIGMAR1 Q99720 4/20 0.45
CSNK1E P49674 1/20 0.42
ANPEP P15144 1/20 0.42
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
SLC6A2 P23975 2/20 0.40
TAAR1 Q96RJ0 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MAOA P21397 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
CYP2A6 P11509 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
SCN4A P35499 2/20 0.40

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
SCHEMBL3401432 0.84 EPHX1 (0.67) EPHX1SIGMAR1CSNK1EANPEPSLC6A2
SCHEMBL172452 0.84 EPHX1 (0.67) EPHX1SIGMAR1CSNK1EANPEPSLC6A2
SCHEMBL14471186 0.84 EPHX1 (0.67) EPHX1SIGMAR1CSNK1EANPEPSLC6A2
Hydrochloric Acid SCHEMBL6659825 0.82 EPHX1 (0.64) EPHX1SIGMAR1CSNK1EANPEPSLC6A2
Bromide SCHEMBL6947335 0.82 EPHX1 (0.64) EPHX1SIGMAR1CSNK1EANPEPSLC6A2
SCHEMBL9468396 0.81 EPHX1 (0.52) EPHX1SIGMAR1CSNK1EANPEPSLC6A2
SCHEMBL2736211 0.80 EPHX1 (0.61) EPHX1SIGMAR1CSNK1EANPEPSLC6A2
SCHEMBL368693 0.80 NOS3 (0.38) EPHX1SIGMAR1MEN1MAPTPKM
Hydrochloric Acid SCHEMBL9468395 0.79 EPHX1 (0.50) EPHX1SIGMAR1CSNK1EANPEPSLC6A2
SCHEMBL368692 0.76 ALDH1A1 (0.38) EPHX1SIGMAR1CSNK1EMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107573326-B Novel benzotriazole derivative and organic electroluminescent device using the same 保土谷化学工业株式会社 2024-03-15 CN disclosed
EP-3432688-B1 ORGANIC ELECTROLUMINESCENCE ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2023-12-20 EP disclosed
CN-112079814-B Benzotriazole derivative and organic electroluminescent device 保土谷化学工业株式会社 2023-11-07 CN disclosed
US-11056653-B2 Organic electroluminescence device HODOGAYA CHEMICAL CO., LTD. (JP) 2021-07-06 US disclosed
CN-112079814-A Benzotriazole derivative and organic electroluminescent device 保土谷化学工业株式会社 2020-12-15 CN disclosed
US-20200328353-A1 Organic Electroluminescence Device HODOGAYA CHEMICAL CO., LTD. (JP) 2020-10-15 US disclosed
EP-2767534-B1 NEW BENZOTRIAZOLE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT IN WHICH SAID DERIVATIVE IS USED HODOGAYA CHEMICAL CO LTD (JP) 2020-06-03 EP disclosed
EP-3432688-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2019-01-23 EP disclosed
EP-2409974-B1 COMPOUND HAVING BENZOTRIAZOLE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2018-04-25 EP disclosed
US-9842999-B2 Benzotriazole derivative and an organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2017-12-12 US disclosed
US-20160164001-A1 A BENZOTRIAZOLE DERIVATIVE AND AN ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2016-06-09 US disclosed
EP-3029034-A1 BENZOTRIAZOLE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2016-06-08 EP disclosed
US-9123897-B2 Benzotriazole derivatives and organic electroluminescent devices using the derivatives HODOGAYA CHEMICAL CO., LTD. (JP) 2015-09-01 US disclosed
US-9005776-B2 Compound having benzotriazole ring structure and organic electroluminescent element HODOGAYA CHEMICAL CO., LTD. (JP) 2015-04-14 US disclosed
US-20140374721-A1 NOVEL BENZOTRIAZOLE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE DERIVATIVES HODOGAYA CHEMICAL CO., LTD (JP) 2014-12-25 US disclosed
EP-2767534-A1 NEW BENZOTRIAZOLE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT IN WHICH SAID DERIVATIVE IS USED Hodogaya Chemical Co., Ltd. (JP) 2014-08-20 EP disclosed
EP-2409974-A1 COMPOUND HAVING BENZOTRIAZOLE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2012-01-25 EP disclosed
US-20120012831-A1 COMPOUND HAVING BENZOTRIAZOLE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENT ELEMENT SHINSHU UNIVERSITY (JP) 2012-01-19 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 (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-20160164001-A1 A BENZOTRIAZOLE DERIVATIVE AND AN ORGANIC ELECTROLUMINESCENT DEVICE AHR, ARNT, NAT1 EPHX1 2062/4885SIGMAR1 3103/4885CSNK1E 4161/4885
US-20120012831-A1 COMPOUND HAVING BENZOTRIAZOLE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENT ELEMENT BRD4, ARNT, MLLT1 EPHX1 3176/4885SIGMAR1 546/4885CSNK1E 2557/4885

“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.