SCHEMBL3661523

SCHEMBL3661523

Cc1cc(C)n(-c2nncnn2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.54
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
MAPT P10636 6/20 0.51
L3MBTL1 Q9Y468 4/20 0.51
GAA P10253 3/20 0.51
HPGD P15428 1/20 0.51
HTT P42858 5/20 0.50
ALOX15 P16050 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 3/20 0.46
RECQL P46063 1/20 0.46
CYP1A2 P05177 2/20 0.46
LMNA P02545 2/20 0.46
CYP2C9 P11712 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TSHR P16473 2/20 0.46
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL3712068 0.87 RAB9A (0.67) SMN1; SMN2NPC1RAB9AMAPTL3MBTL1
SCHEMBL17468789 0.81 RAB9A (0.61) SMN1; SMN2NPC1RAB9AMAPTL3MBTL1
SCHEMBL4138642 0.78 HTT (0.68) SMN1; SMN2NPC1RAB9AMAPTL3MBTL1
SCHEMBL3780684 0.78 HTT (0.61) SMN1; SMN2NPC1RAB9AMAPTL3MBTL1
SCHEMBL17482180 0.78 SMN1; SMN2 (0.57) SMN1; SMN2NPC1RAB9AMAPTL3MBTL1
SCHEMBL7694906 0.76 SMN1; SMN2 (0.70) SMN1; SMN2NPC1RAB9AMAPTL3MBTL1
SCHEMBL4762874 0.75 HTT (0.50) SMN1; SMN2NPC1RAB9AMAPTL3MBTL1
SCHEMBL27930399 0.75 HTT (0.59) SMN1; SMN2NPC1RAB9AMAPTL3MBTL1
SCHEMBL946948 0.74 HTT (0.75) SMN1; SMN2MAPTL3MBTL1GAAHTT
SCHEMBL27926814 0.73 SMN1; SMN2 (0.66) SMN1; SMN2NPC1RAB9AMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116891599-A Engineering tire tread rubber composition and preparation method and application thereof 华勤橡胶工业集团有限公司 2023-10-17 CN claimed
CN-117019104-A Adsorbent for recovering gold from secondary resource 昆明学院 2023-11-10 CN disclosed
CN-116891599-A Engineering tire tread rubber composition and preparation method and application thereof 华勤橡胶工业集团有限公司 2023-10-17 CN disclosed
CN-110382611-B Rubber composition and tire 大塚化学株式会社 2022-09-09 CN disclosed
CN-110382612-B Rubber composition and tire 大塚化学株式会社 2022-04-19 CN disclosed
CN-110382554-B Reaction product and rubber composition 大塚化学株式会社 2022-03-22 CN disclosed
CN-110392713-B Rubber composition and tire 大塚化学株式会社 2022-02-18 CN disclosed
CN-110461931-B Rubber composition and tire 大塚化学株式会社 2022-02-18 CN disclosed
CN-113811569-A Rubber composition for studless tire and studless tire using same 横滨橡胶株式会社 2021-12-17 CN disclosed
CN-113272152-A Rubber composition and rubber product 住友电木株式会社 2021-08-17 CN disclosed
CN-112111090-A Additive for imparting low heat build-up to rubber component 大塚化学株式会社 2020-12-22 CN disclosed
CN-108026332-B Additive for imparting low heat build-up to rubber component 大塚化学株式会社 2020-12-01 CN disclosed
WO-2020230790-A1 RUBBER COMPOSITION FOR STUDLESS TIRE AND STUDLESS TIRE OBTAINED USING SAME 横浜ゴム株式会社 2020-11-19 WO disclosed
WO-2020213708-A1 RUBBER COMPOSITION FOR TIRE, PNEUMATIC TIRE OBTAINED USING SAME, AND METHOD FOR PRODUCING RUBBER COMPOSITION FOR TIRE 横浜ゴム株式会社 2020-10-22 WO disclosed
EP-2220176-B1 SOL-GEL COATING COMPOSITIONS AND THEIR PROCESS OF PREPARATION DUBLIN INSTITUTE OF TECH INTELLECTUAL PROPERTY LTD (IE) 2018-09-19 EP disclosed
CN-107074819-A Energetic compounds and compositions 技术创新动力基金(以色列)有限合伙公司 2017-08-18 CN disclosed
US-9023954-B1 Side-chain and end-group modified poly-p-phenylene oligomers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2015-05-05 US disclosed
US-9023954-B1 Side-chain and end-group modified poly-p-phenylene oligomers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2015-05-05 US disclosed
EP-2220176-A2 SOL-GEL COATING COMPOSITIONS AND THEIR PROCESS OF PREPARATION Dublin Institute of Technology Intellectual Property Ltd (IE) 2010-08-25 EP disclosed
WO-2009069111-A2 SOL-GEL COATING COMPOSITIONS AND THEIR PROCESS OF PREPARATION DUBLIN INSTITUTE OF TECHNOLOGY (IE) 2009-06-04 WO disclosed