SCHEMBL3050460

SCHEMBL3050460

Cc1ccc(N(C)c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.55
ALDH1A1 P00352 2/20 0.55
LMNA P02545 3/20 0.50
ACHE P22303 2/20 0.50
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
ALOX12 P18054 1/20 0.50
CYP2C19 P33261 1/20 0.50
NR3C2 P08235 1/20 0.48
CES1 P23141 2/20 0.47
MEN1 O00255 2/20 0.44
HPGD P15428 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPK1 P28482 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
S1PR4 O95977 1/20 0.44
HSP90AA1 P07900 1/20 0.44
S1PR1 P21453 1/20 0.44
CCR6 P51684 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
Benzene SCHEMBL14537402 1.00 TSHR (0.55) TSHRALDH1A1LMNAACHECA12
Toluene SCHEMBL14537404 0.97 LMNA (0.55) TSHRALDH1A1LMNAACHECA12
SCHEMBL12048237 0.93 ALDH1A1 (0.48) TSHRALDH1A1LMNAACHECA12
SCHEMBL10042841 0.93 ALDH1A1 (0.48) TSHRALDH1A1LMNAACHECA12
SCHEMBL12048234 0.93 ALDH1A1 (0.48) TSHRALDH1A1LMNAACHECA12
SCHEMBL12047759 0.93 ALDH1A1 (0.48) TSHRALDH1A1LMNAACHECA12
SCHEMBL18798514 0.93 ALDH1A1 (0.48) TSHRALDH1A1LMNAACHECA12
SCHEMBL10042882 0.93 ALDH1A1 (0.48) TSHRALDH1A1LMNAACHECA12
SCHEMBL2623413 0.93 CHKA (0.49) TSHRALDH1A1LMNAACHECA12
Toluene SCHEMBL14537403 0.92 TSHR (0.61) TSHRALDH1A1LMNAACHECA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0633144-B1 Pressure-sensitive copying material WIGGINS TEAPE GROUP LTD (GB) 1997-08-13 EP claimed
US-12504684-B2 Core-shell dye, photosensitive resin composition including the same, and color filter SAMSUNG SDI CO., LTD. (KR) 2025-12-23 US disclosed
US-20240018104-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2024-01-18 US disclosed
US-20230329092-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-10-12 US disclosed
US-20230189629-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-06-15 US disclosed
US-20230165130-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE HETEROCYCLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-05-25 US disclosed
US-20230140877-A1 Novel Compound and Organic Light Emitting Device Comprising the Same LG CHEM, LTD. (KR) 2023-05-11 US disclosed
US-20230140877-A1 Novel Compound and Organic Light Emitting Device Comprising the Same LG CHEM, LTD. (KR) 2023-05-11 US disclosed
US-20230140210-A1 INHIBITORS OF PLATELET FUNCTION AND METHODS FOR USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-05-04 US disclosed
US-20230136349-A1 CORE-SHELL DYE, PHOTOSENSITIVE RESIN COMPOSITION INCLUDING THE SAME, AND COLOR FILTER SAMSUNG SDI CO., LTD. (KR) 2023-05-04 US disclosed
WO-2000002887-A2 LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2000-01-20 WO disclosed
CN-1154302-A Pressure-sensitive copying material WIGGINS TEAPE GROUP LTD (GB) 1997-07-16 CN disclosed
EP-0728817-A2 Monoazo compounds and dyeing or printing methods using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-08-28 EP disclosed
EP-0377406-B1 PRESSURE-SENSITIVE OR HEAT-SENSITIVE RECORDING MATERIAL CIBA-GEIGY AG (CH) 1993-06-09 EP disclosed
US-5013707-A Pressure- or heat-sensitive recording material CIBA-GEIGY CORPORATION (US) 1991-05-07 US disclosed
EP-0275110-A2 Colour-developing sheet for pressure-sensitive recording, and colour-developing material therefor JUJO PAPER CO., LTD. (JP) 1988-07-20 EP disclosed
EP-0005451-A2 Process for the manufacture of cationic oxazinic compounds, the oxazinic compounds and their application to the dyeing and printing of textile materials CIBA-GEIGY AG (CH) 1979-11-28 EP disclosed
US-4115413-A ACID FREE BAYER AKTIENGESELLSCHAFT (DE) 1978-09-19 US disclosed
US-4003898-A Process for the manufacture of cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-01-18 US disclosed
US-4002631-A HEAT-SENSITIVE COLOR FORMERS HODOGAYA CHEMICAL CO., LTD. (JA) 1977-01-11 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 (6 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-20230189629-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF L1CAM, LEF1, PIEZO1 TSHR 4349/4885ALDH1A1 645/4885LMNA 1658/4885
US-20230165130-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE HETEROCYCLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE CYP1A1, CYP2E1, AOX1 TSHR 3675/4885ALDH1A1 43/4885LMNA 3052/4885
US-20230329092-A1 MATERIALS FOR ELECTRONIC DEVICES SOD1, GPX1, EFNA1 TSHR 4289/4885ALDH1A1 595/4885LMNA 2834/4885
US-20230140877-A1 Novel Compound and Organic Light Emitting Device Comprising the Same CRY2, CRY1, GLI1 TSHR 4136/4885ALDH1A1 105/4885LMNA 4222/4885
US-20240018104-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF NFE2L2, ESR1, OR51E2 TSHR 4573/4885ALDH1A1 1034/4885LMNA 2619/4885
US-20230140210-A1 INHIBITORS OF PLATELET FUNCTION AND METHODS FOR USE OF THE SAME TFPI, F2, TFPI2 TSHR 2615/4885ALDH1A1 571/4885LMNA 4165/4885

“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.