SCHEMBL3764837

SCHEMBL3764837

CCC(C#N)CCCc1ccc(-c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 4/20 0.49
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CTSH P09668 1/20 0.42
CYP2D6 P10635 1/20 0.42
CTSK P43235 1/20 0.42
CTSC P53634 1/20 0.42
HSD11B1 P28845 2/20 0.42
MME P08473 3/20 0.40
ACE P12821 2/20 0.40
CPA1 P15085 2/20 0.40
ACE2 Q9BYF1 2/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP12 P39900 1/20 0.40
MMP13 P45452 1/20 0.40
MMP14 P50281 1/20 0.40

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
SCHEMBL8939338 0.89 TSHR (0.50) FDFT1TSHRHSD17B10HSD11B1MME
SCHEMBL8939310 0.89 FDFT1 (0.48) FDFT1TSHRHSD17B10HSD11B1MME
SCHEMBL8939339 0.88 TSHR (0.53) FDFT1TSHRHSD17B10HSD11B1MME
SCHEMBL8939308 0.86 TSHR (0.55) FDFT1TSHRHSD17B10HSD11B1MME
SCHEMBL8939324 0.86 TSHR (0.55) FDFT1TSHRHSD17B10HSD11B1MME
SCHEMBL8939328 0.86 TSHR (0.55) FDFT1TSHRHSD17B10HSD11B1MME
SCHEMBL645917 0.82 FDFT1 (0.50) FDFT1TSHRHSD17B10HSD11B1MMP2
SCHEMBL8939352 0.78 LSS (0.50) CYP3A4CYP2D6
SCHEMBL5051381 0.78 ASIC3 (0.38) CYP1A2CYP3A4CTSK
SCHEMBL11440803 0.77 MMP12 (0.53) FDFT1HSD11B1MMP2MMP9MMP12

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117901461-A Multimode dual-signal sensing film and preparation method thereof 河北工业大学 2024-04-19 CN disclosed
CN-113248641-A Variable-temperature anti-counterfeiting material based on structural color and preparation method and application thereof 广东壮丽彩印股份有限公司 2021-08-13 CN disclosed
CN-102374967-B Shear measuring method and its device JAPAN SCIENCE & TECH AGENCY 2014-11-05 CN disclosed
CN-101278184-B Shear measuring method and apparatus JAPAN SCIENCE & TECH AGENCY 2012-07-04 CN disclosed
CN-102374967-A Shear measuring method and its device JAPAN SCIENCE & TECH AGENCY 2012-03-14 CN disclosed
US-7845231-B2 Shear measuring method and its device JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2010-12-07 US disclosed
US-20090145231-A1 SHEAR MEASURING METHOD AND ITS DEVICE JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-06-11 US disclosed
CN-101278184-A Shear measuring method and apparatus JAPAN SCIENCE & TECH AGENCY (JP) 2008-10-01 CN disclosed
EP-1942331-A1 SHEAR MEASURING METHOD AND ITS DEVICE Japan Science and Technology Agency (JP) 2008-07-09 EP disclosed
US-5498363-A Electrorheological fluid AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 1996-03-12 US disclosed