SCHEMBL40538

SCHEMBL40538

O=C(c1ccccc1)c1cccc(Br)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.71
TDP1 Q9NUW8 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
HTT P42858 2/20 0.61
ALOX15 P16050 1/20 0.61
ALDH1A1 P00352 4/20 0.61
PARP1 P09874 1/20 0.61
PBRM1 Q86U86 1/20 0.59
MAPT P10636 2/20 0.56
POLB P06746 1/20 0.56
BRD4 O60885 1/20 0.55
TP53 P04637 1/20 0.53
HPGD P15428 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 1/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
MAOA P21397 1/20 0.53
MAOB P27338 1/20 0.53

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
SCHEMBL3838580 0.93 PARP1 (0.63) ATMTDP1L3MBTL1HTTALOX15
SCHEMBL241785 0.93 PARP1 (0.68) ATMTDP1L3MBTL1HTTALOX15
SCHEMBL30153175 0.93 PARP1 (0.68) ATMTDP1L3MBTL1HTTALOX15
Ethylene Glycol SCHEMBL9374647 0.92 L3MBTL1 (0.61) ATMTDP1L3MBTL1HTTALOX15
Hydrochloric Acid SCHEMBL27869733 0.91 PARP1 (0.65) ATMTDP1L3MBTL1HTTALOX15
SCHEMBL22172116 0.91 ATM (0.59) ATMTDP1L3MBTL1HTTALOX15
SCHEMBL3838117 0.89 PARP1 (0.59) ATMTDP1L3MBTL1HTTALOX15
SCHEMBL782415 0.88 ATM (0.61) ATMTDP1L3MBTL1HTTALOX15
SCHEMBL3842568 0.88 AKR1C3 (0.58) ATMTDP1L3MBTL1HTTALOX15
Benzophenone SCHEMBL28640629 0.86 ATM (0.57) ATMTDP1L3MBTL1HTTALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118771976-A Preparation method of ketoprofen-d 3 宁波萃英化学技术有限公司 2024-10-15 CN claimed
CN-112961157-A Indolocarbazole-based organic luminescent material and preparation method and application thereof 电子科技大学 2021-06-15 CN claimed
CN-106632998-A Barbier-reaction-based method for preparing high molecules 中国石油大学(华东) 2017-05-10 CN claimed
EP-1095005-A1 PREPARATION OF CARBOXYLIC COMPOUNDS AND THEIR DERIVATIVES ALBEMARLE CORPORATION (US) 2001-05-02 EP claimed
US-6096920-A LARGE-SCALE PRODUCTION OF CERTAIN AROMATICALLY-SUBSTITUTED ALIPHATIC CARBOXYLIC ACIDS AND THEIR ACID DERIVATIVES ALBEMARLE CORPORATION (US) 2000-08-01 US claimed
WO-2000002840-A1 PREPARATION OF CARBOXYLIC COMPOUNDS AND THEIR DERIVATIVES ALBEMARLE CORPORATION (US) 2000-01-20 WO claimed
US-5536870-A Process for preparing olefins ALBEMARLE CORPORATION (US) 1996-07-16 US claimed
EP-0451261-B1 AGENT AND PROCESS FOR BLEACHING HAIR UNDER THE ACTION OF LIGHT Wella Aktiengesellschaft (DE) 1993-09-15 EP claimed
EP-0451261-A1 AGENT AND PROCESS FOR BLEACHING HAIR UNDER THE ACTION OF LIGHT. WELLA AG (DE) 1991-10-16 EP claimed
WO-1991006279-A2 AGENT AND PROCESS FOR BLEACHING HAIR UNDER THE ACTION OF LIGHT WELLA AKTIENGESELLSCHAFT (DE) 1991-05-16 WO claimed
JP-55002614-A None JP disclosed
CN-120208774-A Preparation method of ketoprofen-d 3 宁波萃英化学技术有限公司 2025-06-27 CN disclosed
CN-114981254-B Compound for organic electronic element, organic electronic element using the same, and electronic device having the same 德山新勒克斯有限公司 2025-06-24 CN disclosed
US-20250194419-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2025-06-12 US disclosed
US-12268091-B2 Organic electroluminescence device and amine compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2025-04-01 US disclosed
US-4162364-A ANTIINFLAMMATORY AGENT LEK TOVARNA FARMACEVTSKIH IN KEMICNIH IZDELKOV, N.SOL.O. (YU) 1979-07-24 US disclosed
US-4147729-A ANTIRHEUMATIC AGENTS LEK tovarna farmacevtskih in kemicnih izdelkov, n.sol.o (YU) 1979-04-03 US disclosed
US-4120687-A CONTROLLING GROWTH OF TOBACCO SUCKERS MEISINGER ROBERT H 1978-10-17 US disclosed
US-4113972-A ANTIDEPRESSANTS BEECHAM GROUP LIMITED (GB) 1978-09-12 US disclosed
US-4101676-A Diphenylpropylamines to treat depression BEECHAM GROUP LIMITED (GB) 1978-07-18 US disclosed