SCHEMBL109886

SCHEMBL109886

CCCCOc1cccc(N)c1

nearest known ligand 0.86

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.86
CYP3A4 P08684 2/20 0.69
TP53 P04637 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.54
ALDH1A1 P00352 1/20 0.53
LTA4H P09960 2/20 0.53
MAOB P27338 1/20 0.53
DHFR P00374 1/20 0.50
TLR4 O00206 1/20 0.49
TLR2 O60603 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP19A1 P11511 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
KMT2A Q03164 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
SCHEMBL13169872 0.94 TSHR (0.96) TSHRCYP3A4TP53ALDH1A1LTA4H
SCHEMBL17402431 0.93 TSHR (1.00) TSHRCYP3A4TP53LTA4HDHFR
SCHEMBL4951306 0.93 TSHR (1.00) TSHRCYP3A4TP53LTA4HDHFR
SCHEMBL31612272 0.93 TSHR (1.00) TSHRCYP3A4TP53LTA4HDHFR
SCHEMBL11297325 0.93 TSHR (1.00) TSHRCYP3A4TP53LTA4HDHFR
SCHEMBL5145915 0.93 TSHR (1.00) TSHRCYP3A4TP53LTA4HDHFR
SCHEMBL9170593 0.93 TSHR (1.00) TSHRCYP3A4TP53LTA4HDHFR
SCHEMBL18760118 0.93 TSHR (1.00) TSHRCYP3A4TP53LTA4HDHFR
SCHEMBL21295950 0.93 TSHR (1.00) TSHRCYP3A4TP53LTA4HDHFR
SCHEMBL11546346 0.93 TSHR (1.00) TSHRCYP3A4TP53LTA4HDHFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113801254-A Polypropylene catalyst and preparation method thereof 中国石油天然气股份有限公司 2021-12-17 CN claimed
US-20140364566-A1 SCALE-UP PROCESS OF BIFUNCTIONALIZED TRIBLOCK COPOLYMERS WITH SECONDARY AND TERTIARY AMINES, WITH APPLICATION IN DEWATERING AND DESALTING OF HEAVY CRUDE OILS INSTITUTO MEXICANO DEL PETROLEO (MX) 2014-12-11 US claimed
EP-4656602-A2 MEMBRANES FOR REMOVING METALLIC SPECIES FROM AMINES Entegris, Inc. (US) 2025-12-03 EP disclosed
CN-116018381-B Polarizing film, polarizing plate and liquid crystal display device containing azo compound or salt thereof 日本化药株式会社 2025-05-02 CN disclosed
CN-119677819-A Azo compound or salt thereof, and polarizing film, polarizing plate and liquid crystal display device each containing the same 日本化药株式会社 2025-03-21 CN disclosed
US-20240350984-A1 MEMBRANES FOR REMOVING METALLIC SPECIES FROM AMINES ENTEGRIS, INC. 2024-10-24 US disclosed
US-12059656-B2 Membranes for removing metallic species from amines ENTEGRIS, INC. (US) 2024-08-13 US disclosed
CN-114945636-B Azo compound or salt thereof, polarizing film, polarizing plate, and display device 日本化药株式会社 2024-07-12 CN disclosed
CN-107533259-B Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element 日产化学工业株式会社 2024-06-21 CN disclosed
CN-118043732-A Weak anchoring liquid crystal aligning agent, liquid crystal display element and polymer 日产化学株式会社 2024-05-14 CN disclosed
CN-114008143-B Azo compound, polarizing film containing the same, and polarizing plate 日本化药株式会社 2024-05-14 CN disclosed
EP-0568497-A1 Chromogene methylenepyrrolins CIBA-GEIGY AG (CH) 1993-11-03 EP disclosed
EP-0014344-B1 COUMARIN COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS WHITENERS AND LASER DYES BAYER AG (DE) 1982-04-21 EP disclosed
US-4326066-A Triazolyl coumarin compounds, processes for their preparation and their use as whiteners and laser dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1982-04-20 US disclosed
US-4294756-A AZO-IMIDAZOLE DYE, POLYACRYLONITRILE BAYER AKTIENGESELLSCHAFT (DE) 1981-10-13 US disclosed
EP-0014344-A1 Coumarin compounds, process for their preparation and their use as whiteners and laser dyes BAYER AG (DE) 1980-08-20 EP disclosed
US-4102885-A Process for preparing 2,4-dihaloquinazolines BRISTOL-MYERS COMPANY (US) 1978-07-25 US disclosed
US-4084051-A BACTERICIDES, HERBICIDES STERLING DRUG INC. (US) 1978-04-11 US disclosed
US-4046775-A 4,5-Dihalopyrrole-2-carboxamides STERLING DRUG INC. (US) 1977-09-06 US disclosed
US-3963480-A Herbicidal pyrrole-2-carboxamides STERLING DRUG INC. (US) 1976-06-15 US disclosed