SCHEMBL127620

SCHEMBL127620

Nc1ccccc1N1CCOCC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.64
ADRA2C P18825 1/20 0.60
LGMN Q99538 3/20 0.59
GAA P10253 3/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
USP2 O75604 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.54
NPC1 O15118 2/20 0.54
ALDH1A1 P00352 3/20 0.53
LMNA P02545 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MAPT P10636 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
POLB P06746 2/20 0.50
NCF1 P14598 1/20 0.50
THRB P10828 1/20 0.50
RECQL P46063 1/20 0.50
BLM P54132 1/20 0.50
RAB9A P51151 1/20 0.49

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
SCHEMBL30443433 1.00 KEAP1 (0.64) KEAP1ADRA2CLGMNGAAMEN1
Hydrochloric Acid SCHEMBL9424019 0.98 KEAP1 (0.62) KEAP1ADRA2CLGMNGAAMEN1
Hydrochloric Acid SCHEMBL23536416 0.98 KEAP1 (0.62) KEAP1ADRA2CLGMNGAAMEN1
Aniline SCHEMBL22169106 0.93 LGMN (0.57) KEAP1ADRA2CLGMNGAAMEN1
SCHEMBL3434299 0.93 KEAP1 (0.67) KEAP1ADRA2CLGMNGAAMEN1
SCHEMBL9424119 0.84 LMNA (0.62) LGMNGAAMEN1KMT2ASMN1; SMN2
SCHEMBL23152040 0.84 ADRA2C (0.79) KEAP1ADRA2CLGMNGAAMEN1
SCHEMBL11775877 0.84 ADRA2C (0.79) KEAP1ADRA2CLGMNGAAMEN1
SCHEMBL904453 0.84 LGMN (0.51) KEAP1ADRA2CLGMNGAAMEN1
SCHEMBL31248708 0.84 LGMN (0.51) KEAP1ADRA2CLGMNGAAMEN1

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 1626 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117186472-A High-temperature-resistant stretch-resistant colorful film and preparation method thereof 新航涂布科技(苏州)有限公司 2023-12-08 CN claimed
CN-104974149-B A kind of preparation method of razaxaban 北大方正集团有限公司 2018-05-01 CN claimed
CN-104974148-B The method of one kind synthesis ketone of 4 { 4 [base of 1,3 oxazolidine of (5S) 5 (amino methyl) 2 oxo 3] phenyl } morpholine 3 北大方正集团有限公司 2017-11-24 CN claimed
CN-105085507-B A kind of method for synthesizing razaxaban 北大方正集团有限公司 2017-11-24 CN claimed
EP-2611797-B1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI SCIENCE CO LTD (KR) 2016-12-28 EP claimed
US-8835458-B2 Quinoline or quinazoline derivatives with apoptosis inducing activity on cells HANMI SCIENCE CO., LTD (KR) 2014-09-16 US claimed
EP-2611797-A2 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS Hanmi Science Co., Ltd. (KR) 2013-07-10 EP claimed
US-20130165386-A1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI SCIENCE CO., LTD (KR) 2013-06-27 US claimed
WO-2012030160-A2 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI HOLDINGS CO., LTD. (KR) 2012-03-08 WO claimed
US-8043385-B2 Composition oxidation colouring of keratinic fibres, containing a cationic cellulose ether, a metasilicate and oxidation dyes, method for oxidation colouring and uses thereof L'OREAL S.A. (FR) 2011-10-25 US claimed
US-4692166-A OXIDATION COLOR DYES USED WITH DIAMINOBENZENES OR AMINO PHENOLS; MINIMIZATION OF RED HUE L'OREAL (FR) 1987-09-08 US claimed
US-4563188-A SHADES OF GREEN L'OREAL (FR) 1986-01-07 US claimed
US-4425132-A HAIR DYES, APPLYING WITHOUT RINSING L'OREAL (FR) 1984-01-10 US claimed
US-4337061-A NITRO DYES IN AQUEOUS SOLUTION SOCIETE ANONYME DITE: L'OREAL (FR) 1982-06-29 US claimed
US-4323360-A Dyeing compositions for hair which contain 2,4-diamino-butoxybenzene and/or a salt thereof as the coupling agent L'OREAL (FR) 1982-04-06 US claimed
US-4289495-A HAIR DYES, STORAGE STABILITY L'OREAL (FR) 1981-09-15 US claimed
US-4200432-A HAIR DYES L'OREAL (FR) 1980-04-29 US claimed
US-4149848-A N-/TETRAHYDROFURFURYL/P-PHENYLENEDIAMINES L'OREAL (FR) 1979-04-17 US claimed
US-3961879-A P-PHENYLENEDIAMINE, HAIR L'OREAL (FR) 1976-06-08 US claimed
US-3948596-A Oxidation dye for keratinic fibers containing 2-halo-5-acetaminophenol as a coupler SOCIETE ANONYME DITE: L'OREAL (FR) 1976-04-06 US claimed

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-20130165386-A1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS CASP7, API5, BAX KEAP1 475/4885ADRA2C 4016/4885LGMN 3300/4885

“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.