SCHEMBL49617

SCHEMBL49617

CCCCP(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.38
TSHR P16473 2/20 0.38
LTA4H P09960 2/20 0.38
PCSK9 Q8NBP7 1/20 0.38
CYP3A4 P08684 1/20 0.38
PTGS2 P35354 1/20 0.36
CES2 O00748 2/20 0.35
CES1 P23141 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
TP53 P04637 1/20 0.35
DNM1 Q05193 1/20 0.34

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
Iodide SCHEMBL28208394 0.98 TDP1 (0.37) TDP1TSHRLTA4HPCSK9CYP3A4
SCHEMBL27678243 0.98 TDP1 (0.37) TDP1TSHRLTA4HPCSK9CYP3A4
Hydrochloric Acid SCHEMBL28975804 0.98 TDP1 (0.37) TDP1TSHRLTA4HPCSK9CYP3A4
Bromide SCHEMBL1577209 0.98 TDP1 (0.37) TDP1TSHRLTA4HPCSK9CYP3A4
SCHEMBL30514704 0.98 TDP1 (0.37) TDP1TSHRLTA4HPCSK9CYP3A4
Hydrochloric Acid SCHEMBL28497176 0.98 TDP1 (0.37) TDP1TSHRLTA4HPCSK9CYP3A4
SCHEMBL27687803 0.98 TDP1 (0.37) TDP1TSHRLTA4HPCSK9CYP3A4
SCHEMBL10585317 0.98 TDP1 (0.37) TDP1TSHRLTA4HPCSK9CYP3A4
SCHEMBL9414101 0.98 TDP1 (0.37) TDP1TSHRLTA4HPCSK9CYP3A4
Hydrochloric Acid SCHEMBL6293230 0.98 TDP1 (0.37) TDP1TSHRLTA4HPCSK9CYP3A4

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

Appears in 5192 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4594306-A1 SYNTHESIS METHODS AND INTERMEDIATES FOR THE PRODUCTION OF REMIBRUTINIB Novartis AG (CH) 2025-08-06 EP claimed
EP-3774719-B1 METHOD FOR THE PREPARATION OF 2.6-DIALKYLPHENYL ACETIC ACIDS BAYER AG (DE) 2025-07-23 EP claimed
CN-119529260-A Polycaprolactone-poly (2-vinyl) ethylene glycol copolymer and preparation method thereof 上海交通大学 2025-02-28 CN claimed
CN-115298163-B Preparation of aromatic carboxamides by palladium catalyzed carbonylation 巴斯夫欧洲公司 2024-11-19 CN claimed
CN-118344258-A Organic photoconductor drum based on triarylamine derivative material, and preparation method and application thereof 中国科学院化学研究所 2024-07-16 CN claimed
CN-111417627-B Hydrogenation of Imines Using RU Complexes 弗门尼舍有限公司 2024-07-12 CN claimed
CN-118307554-A E-containing double bond 11-membered ring compound and preparation method thereof 天津大学 2024-07-09 CN claimed
CN-118290261-A Esterification method of aryl fluorosulfonate and aryl formate 南京工业大学 2024-07-05 CN claimed
CN-118271215-A Method for synthesizing 2-methylthio-4-trifluoromethyl benzoic acid 江苏中旗科技股份有限公司 2024-07-02 CN claimed
CN-118271180-A Preparation method of allylamine compound 大连理工大学 2024-07-02 CN claimed
US-4593128-A Using a di- or triphenylphosphine compound ATLANTIC RICHFIELD COMPANY (US) 1986-06-03 US claimed
CN-85108407-A Hydroquinone derivative's preparation method 1986-05-10 CN claimed
EP-0174174-A2 A method of stabilising hydroxy-containing polymers of butadiene or substituted derivatives thereof ELF ATOCHEM S.A. (FR) 1986-03-12 EP claimed
EP-0119899-B1 PROCESS FOR THE PREPARATION OF 4-PENTENOIC ACID DERIVATIVES ROUSSEL-UCLAF (FR) 1986-03-05 EP claimed
EP-0019296-B1 PROCESS FOR REMOVING TRIORGANOPHOSPHINE FROM A LIQUID COMPOSITION UNION CARBIDE CORPORATION (US) 1983-05-04 EP claimed
US-4351969-A Preparation of chlorophenols RHONE-POULENC INDUSTRIES (FR) 1982-09-28 US claimed
US-4283304-A MIXING WITH AN A,B-UNSATURATED COMPOUND UNION CARBIDE CORPORATION (US) 1981-08-11 US claimed
EP-0019296-A1 Process for removing triorganophosphine from a liquid composition UNION CARBIDE CORPORATION (US) 1980-11-26 EP claimed
US-4151171-A CARBONYLATION, HYDROLYSIS, DECARBONYLATION, CYCLIZATION CHEVRON RESEARCH COMPANY (US) 1979-04-24 US claimed
US-4113735-A Process for the production of N-acetyl-2-pyrrolidone CHEVRON RESEARCH COMPANY (US) 1978-09-12 US claimed