SCHEMBL2845757

SCHEMBL2845757

CCCCCCCCN(CCCCCCCC)Cn1nnc2c(C(=O)O)cccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 3/20 0.41
▸ HCAR3 P49019 2/20 0.38
▸ SLC9A1 P19634 3/20 0.38
▸ ICMT O60725 1/20 0.38
▸ ALB P02768 1/20 0.38
▸ CA12 O43570 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ ASAH1 Q13510 1/20 0.35
▸ PPARG P37231 2/20 0.35
▸ PSEN1 P49768 1/20 0.35
▸ PSEN2 P49810 1/20 0.35
▸ APH1B Q8WW43 1/20 0.35
▸ NCSTN Q92542 1/20 0.35
▸ APH1A Q96BI3 1/20 0.35
▸ PSENEN Q9NZ42 1/20 0.35
▸ MCHR1 Q99705 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ OPRM1 P35372 1/20 0.34
▸ DRD3 P35462 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
SCHEMBL29829113 1.00 GRM2 (0.41) GRM2HCAR3SLC9A1ICMTALB
SCHEMBL29564879 0.95 GRM2 (0.43) GRM2HCAR3SLC9A1CA12CA9
SCHEMBL2848831 0.95 GRM2 (0.43) GRM2HCAR3SLC9A1CA12CA9
SCHEMBL15517000 0.84 GRM2 (0.35) GRM2ALDH1A1
SCHEMBL11490926 0.84 GRM2 (0.56) GRM2HCAR3SLC9A1PSEN1PSEN2
SCHEMBL30627901 0.82 GRM2 (0.46) GRM2SLC9A1MCHR1DRD2OPRM1
SCHEMBL6241554 0.82 GRM2 (0.46) GRM2SLC9A1MCHR1DRD2OPRM1
SCHEMBL17728249 0.82 GRM2 (0.46) GRM2SLC9A1MCHR1DRD2OPRM1
SCHEMBL2851551 0.81 ALDH1A1 (0.38) GRM2HCAR3ALDH1A1
SCHEMBL28411473 0.81 GRM2 (0.62) GRM2HCAR3SLC9A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11702567-B2 Moisture curable organopolysiloxane composition and electric/electronic apparatus DOW SILICONES CORPORATION (US) 2023-07-18 — — US disclosed
US-20230053517-A1 COLORANT FOR HEAT TRANSFER FLUID, AND COMPOSITION COMPRISING SAME KD FINECHEM CO., LTD. (KR) 2023-02-23 — — US disclosed
EP-3103842-B1 CURABLE SILICONE COMPOSITION, CURED OBJECT THEREOF, AND OPTICAL SEMICONDUCTOR DEVICE DOW TORAY CO LTD (JP) 2023-01-11 — — EP disclosed
EP-3802717-B1 MOISTURE CURABLE ORGANOPOLYSILOXANE COMPOSITION AND ELECTRIC/ELECTRONIC APPARATUS DOW SILICONES CORP (US) 2022-12-21 — — EP disclosed
EP-4074781-A1 COLORANT FOR HEAT TRANSFER FLUID, AND COMPOSITION COMPRISING SAME KD Finechem Co., Ltd. (KR) 2022-10-19 — — EP disclosed
EP-3039079-B1 CURABLE SILICONE COMPOSITION, CURED PRODUCT THEREOF, AND OPTICAL SEMICONDUCTOR DEVICE DDP SPECIALTY ELECTRONIC MAT US 9 LLC (US) 2022-05-18 — — EP disclosed
WO-2022092490-A1 COOLING LIQUID COMPOSITION FOR ELECTRIC VEHICLE 주식회사 케이디파인켐 2022-05-05 — — WO disclosed
WO-2022092491-A1 HEAT TRANSFER FLUID COMPOSITION WITH IMPROVED THERMAL STABILITY 주식회사 케이디파인켐 2022-05-05 — — WO disclosed
US-20210238444-A1 MOISTURE CURABLE ORGANOPOLYSILOXANE COMPOSITION AND ELECTRIC/ELECTRONIC APPARATUS DOW SILICONES CORPORATION 2021-08-05 — — US disclosed
EP-3802717-A1 MOISTURE CURABLE ORGANOPOLYSILOXANE COMPOSITION AND ELECTRIC/ELECTRONIC APPARATUS Dow Silicones Corporation (US) 2021-04-14 — — EP disclosed
WO-2015030224-A1 CURABLE SILICONE COMPOSITION, CURED PRODUCT THEREOF, AND OPTICAL SEMICONDUCTOR DEVICE DOW CORNING CORPORATION (US) 2015-03-05 — — WO disclosed
WO-2014126265-A1 CURABLE SILICONE COMPOSITION, CURED PRODUCT THEREOF, AND OPTICAL SEMICONDUCTOR DEVICE DOW CORNING TORAY CO., LTD. (JP) 2014-08-21 — — WO disclosed
WO-2014104389-A2 CURABLE SILICONE COMPOSITION, CURED PRODUCT THEREOF, AND OPTICAL SEMICONDUCTOR DEVICE DOW CORNING TORAY CO., LTD. (JP) 2014-07-03 — — WO disclosed
WO-2014104390-A2 CURABLE SILICONE COMPOSITION, CURED PRODUCT THEREOF, AND OPTICAL SEMICONDUCTOR DEVICE DOW CORNING TORAY CO., LTD. (JP) 2014-07-03 — — WO disclosed
WO-2014104388-A2 CURABLE SILICONE COMPOSITION, CURED PRODUCT THEREOF, AND OPTICAL SEMICONDUCTOR DEVICE DOW CORNING TORAY CO., LTD. (JP) 2014-07-03 — — WO disclosed
WO-2014038727-A2 CURABLE SILICONE COMPOSITION AND OPTICAL SEMICONDUCTOR DEVICE DOW CORNING TORAY CO., LTD. (JP) 2014-03-13 — — WO disclosed
EP-2159274-B1 BRAKE FLUID CONTAINING TETRAZOLE CHIYODA CHEMICAL CO LTD (JP) 2013-04-17 — — EP disclosed
US-8357642-B2 Functional fluid CHIYODA CHEMICAL CO., LTD. (JP) 2013-01-22 — — US disclosed
US-20100137174-A1 FUNCTIONAL FLUID CHIYODA CHEMICAL CO., LTD. (JP) 2010-06-03 — — US disclosed
EP-2159274-A1 FUNCTIONAL FLUID Chiyoda Chemical Co. Ltd (JP) 2010-03-03 — — EP disclosed
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