SCHEMBL2680262

SCHEMBL2680262

N#Cc1ccc2ccccc2c1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
ALDH1A1 P00352 6/20 0.44
HSD17B10 Q99714 4/20 0.44
TSHR P16473 2/20 0.44
CYP2A6 P11509 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 3/20 0.44
GAA P10253 2/20 0.43
HPGD P15428 2/20 0.41
CYP3A4 P08684 1/20 0.41
KEAP1 Q14145 1/20 0.41
HPRT1 P00492 2/20 0.41
F12 P00748 1/20 0.41
PLAU P00749 1/20 0.41
NCF1 P14598 1/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
BACE1 P56817 1/20 0.41

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
SCHEMBL5750401 0.82 CA1 (0.46) CA1CA2ALDH1A1HSD17B10TDP1
SCHEMBL689190 0.79 ALDH1A1 (0.44) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL13948301 0.78 CA1 (0.53) CA1CA2ALDH1A1HSD17B10TSHR
SCHEMBL646163 0.77 CA1 (0.52) CA1CA2ALDH1A1HSD17B10TSHR
SCHEMBL1644856 0.75 CA1 (0.55) CA1CA2ALDH1A1HSD17B10TSHR
SCHEMBL5950664 0.75 TSHR (0.54) CA1CA2ALDH1A1HSD17B10TSHR
SCHEMBL1644197 0.75 CA1 (0.50) CA1CA2ALDH1A1HSD17B10TSHR
SCHEMBL6235232 0.75 CA1 (0.50) CA1CA2ALDH1A1HSD17B10TSHR
SCHEMBL16581281 0.75 CA1 (0.50) CA1CA2ALDH1A1HSD17B10TSHR
SCHEMBL11556490 0.75 CYP2A6 (0.54) CA1CA2ALDH1A1HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120028308-A Small molecule Raman probe, bar code probe, encoding method and application thereof 北京大学 2025-05-23 CN claimed
JP-2215760-A None JP disclosed
CN-120028308-A Small molecule Raman probe, bar code probe, encoding method and application thereof 北京大学 2025-05-23 CN disclosed
US-10957865-B2 Organic light emitting compound and organic light emitting diode including the same SFC CO., LTD. (KR) 2021-03-23 US disclosed
US-20210057655-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME SFC CO., LTD. (KR) 2021-02-25 US disclosed
US-10749118-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-08-18 US disclosed
US-10741768-B2 Organic light-emitting diode with high efficiency SFC CO., LTD. (KR) 2020-08-11 US disclosed
US-10651397-B2 Organic light emitting compound and organic light emitting device comprising the same SFC CO., LTD. (KR) 2020-05-12 US disclosed
EP-3275970-B1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME SFC CO LTD (KR) 2019-05-22 EP disclosed
EP-3333241-A1 ORGANIC LIGHT EMITTING ELEMENT HAVING HIGH EFFICIENCY SFC Co., Ltd. (KR) 2018-06-13 EP disclosed
CN-1265645-A Urokinase inhibitors ABBOTT LAB (US) 2000-09-06 CN disclosed
EP-0942019-A2 Non-linear optically active copolymers, polyadducts formed from it and their use in non-linear optical media SIEMENS AKTIENGESELLSCHAFT (DE) 1999-09-15 EP disclosed
EP-0911334-A1 QUINOLINOMORPHINANE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 1999-04-28 EP disclosed
EP-0368212-B1 Herbicidal agents containing 2-(4-heteroaryloxy) or 2-(4-aryloxy) phenoxy-acetic or propionic acid and/or cyclohexenone derivatives as active ingredients and naphthalene derivatives as antidotes BASF AG (DE) 1995-09-20 EP disclosed
EP-0456090-B1 Herbicidal agents containing cyclohexenone derivatives as active ingredients and naphthalene derivatives as antidotes BASF AG (DE) 1994-07-13 EP disclosed
EP-0456090-A2 Herbicidal agents containing cyclohexenone derivatives as active ingredients and naphthalene derivatives as antidotes BASF Aktiengesellschaft (DE) 1991-11-13 EP disclosed
US-5035736-A Plant safening agents BASF AKTIENGESELLSCHAFT (DE) 1991-07-30 US disclosed
JP-H02215760-A NEW NAPHTHALENEDICARBONITRILE COMPOUND MITSUI TOATSU CHEM INC 1990-08-28 JP disclosed
EP-0368212-A2 Herbicidal agents containing 2-(4-heteroaryloxy) or 2-(4-aryloxy) phenoxy-acetic or propionic acid and/or cyclohexenone derivatives as active ingredients and naphthalene derivatives as antidotes BASF Aktiengesellschaft (DE) 1990-05-16 EP disclosed
US-4137254-A Preparation of aromatic nitriles TEXACO, INC. (US) 1979-01-30 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 (5 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-10741768-B2 Organic light-emitting diode with high efficiency ALDH1A2, CYBA, LPO CA1 3920/4885CA2 3140/4885ALDH1A1 19/4885
US-20210057655-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME HARS1, ALDH1A2, ALDH1A1 CA1 4571/4885CA2 3806/4885ALDH1A1 3/4885
US-10651397-B2 Organic light emitting compound and organic light emitting device comprising the same MAP1LC3C, CRY1, MAP1LC3A CA1 3628/4885CA2 3072/4885ALDH1A1 459/4885
US-10957865-B2 Organic light emitting compound and organic light emitting diode including the same HARS1, ALDH1A2, ALDH1A1 CA1 4498/4885CA2 3819/4885ALDH1A1 3/4885
US-10749118-B2 Heterocyclic compound and organic light-emitting device including the same CYP1A1, CRY1, CYP1B1 CA1 1959/4885CA2 3751/4885ALDH1A1 13/4885

“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.