SCHEMBL7463139

SCHEMBL7463139

NC1=C(c2ccccc2)C(=O)N=N1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.38
KMT2A Q03164 2/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
CYP3A4 P08684 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NOTUM Q6P988 1/20 0.36
ADORA2A P29274 3/20 0.35
ADORA1 P30542 2/20 0.35
POLB P06746 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADORA2B P29275 1/20 0.35
TDO2 P48775 1/20 0.35
ASIC3 Q9UHC3 1/20 0.35
AURKA O14965 1/20 0.35
HSP90AA1 P07900 1/20 0.35
PRKACA P17612 1/20 0.35

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
SCHEMBL10359088 0.76 PDE4B (0.39) PDE4BKMT2AMAPTLMNAHTT
SCHEMBL182947 0.74 PDE4B (0.42) PDE4BKMT2AMAPTLMNAHTT
SCHEMBL11094676 0.74 PDE4B (0.38) PDE4BKMT2AMAPTLMNAHTT
SCHEMBL27458707 0.74 TAAR1 (0.38) PDE4BKMT2AMAPTLMNAHTT
SCHEMBL10695376 0.72 FGFR1 (0.46) MAPTLMNACYP3A4HSD17B10TDP1
SCHEMBL692285 0.71 FGFR1 (0.43) PDE4BKMT2ALMNAHSP90AA1FGFR1
SCHEMBL8670870 0.71 PDE4B (0.46) PDE4BKMT2AMAPTLMNAHTT
SCHEMBL10688416 0.70 MAPT (0.36) KMT2AMAPTLMNAHTTCYP3A4
SCHEMBL8373650 0.69 GSK3B (0.49) KMT2AMAPTLMNAHSD17B10TDP1
SCHEMBL5232817 0.69 P2RX7 (0.35) PDE4BKMT2AMAPTLMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9579390-B2 Compounds and methods for producing a conjugate REDWOOD BIOSCIENCE, INC. (US) 2017-02-28 US disclosed
US-20160038602-A1 Compounds and Methods for Producing a Conjugate REDWOOD BIOSCIENCE, INC. 2016-02-11 US disclosed
EP-2916835-A1 COMPOUNDS AND METHODS FOR PRODUCING A CONJUGATE Redwood Bioscience, Inc. (US) 2015-09-16 EP disclosed
CN-104884056-A Compounds and methods for preparing conjugates REDWOOD BIOSCIENCE INC 2015-09-02 CN disclosed
WO-2014074218-A1 COMPOUNDS AND METHODS FOR PRODUCING A CONJUGATE REDWOOD BIOSCIENCE, INC. (US) 2014-05-15 WO disclosed
EP-1231889-A2 DIRECT HAIR DYES AND USE THEREOF Henkel Kommanditgesellschaft auf Aktien (DE) 2002-08-21 EP disclosed
EP-1218344-A2 OXIDATION COLORANT STARTING PRODUCTS Henkel Kommanditgesellschaft auf Aktien (DE) 2002-07-03 EP disclosed
EP-1210060-A2 NEW DEVELOPER-COUPLER COMBINATIONS Henkel Kommanditgesellschaft auf Aktien (DE) 2002-06-05 EP disclosed
EP-1185234-A1 NEW COUPLING COMPONENTS FOR OXIDATION HAIR COLORANTS Henkel Kommanditgesellschaft auf Aktien (DE) 2002-03-13 EP disclosed
WO-2001026615-A2 DIRECT HAIR DYES CONTAINING A HYDROXYANTHROQUINONE DERIVATIVE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-04-19 WO disclosed
EP-0001629-A1 Water-soluble, fibre-reactive, green azo-phthalocyanine dyestuffs, their preparation and their use CASSELLA Aktiengesellschaft (DE) 1979-05-02 EP disclosed
US-4112227-A DIURETIC, SALURETIC, ANTIHYPERTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DE) 1978-09-05 US disclosed
US-4081596-A DIURETIC, SALURETIC, ANTIHYPERTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DT) 1978-03-28 US disclosed
US-4056533-A HYPOTENSIVE AGENTS, ANTICOAGULANTS, DIURETICS BAYER AKTIENGESELLSCHAFT (DT) 1977-11-01 US disclosed
US-4005215-A DIURETIC BAYER AKTIENGESELLSCHAFT (DT) 1977-01-25 US disclosed
US-4000294-A DIURESIS OR SALURESIS BAYER AKTIENGESELLSCHAFT (DT) 1976-12-28 US disclosed
US-3992404-A DIURETICS, SALURETICS, ANTIHYPERTENSIVE AGENTS, AND ANTITHROMBOTIC AGENTS BAYER AKTIENGESELLSCHAFT (DT) 1976-11-16 US disclosed
US-3978077-A DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (GB) 1976-08-31 US disclosed
US-3957814-A DIURETICS, SALURETICS, HYPOTENSIVE AGENTS, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-05-18 US disclosed
US-3952008-A DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-04-20 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 (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-20160038602-A1 Compounds and Methods for Producing a Conjugate BCR, PAICS, MMAB PDE4B 1683/4885KMT2A 1674/4885MAPT 1344/4885

“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.