SCHEMBL920499

SCHEMBL920499

[CH2]CCCCc1cccs1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.59
TSHR P16473 2/20 0.51
ADRA2A P08913 3/20 0.48
ADRA2B P18089 3/20 0.48
ADRA2C P18825 3/20 0.48
NPC1 O15118 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
RAB9A P51151 1/20 0.40
CYP2C19 P33261 1/20 0.38
USP2 O75604 1/20 0.38
CASP3 P42574 1/20 0.37
CASP7 P55210 1/20 0.37

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
SCHEMBL503865 0.98 TAAR1 (0.57) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL16289362 0.98 TAAR1 (0.57) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL5574711 0.98 TAAR1 (0.57) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL7022576 0.98 TAAR1 (0.57) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL5575338 0.98 TAAR1 (0.57) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL8499299 0.98 TAAR1 (0.57) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL16289455 0.98 TAAR1 (0.57) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL94727 0.93
SCHEMBL20146704 0.89 TAAR1 (0.73) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL2090227 0.88 TAAR1 (0.47) TAAR1TSHRADRA2AADRA2BADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108191740-A Spirocyclopropane base oxidized indole compounds and preparation method thereof 西华师范大学 2018-06-22 CN claimed
CN-101506191-A Aromatic amine derivative and organic electroluminescent element using same IDEMITSU KOSAN CO (JP) 2009-08-12 CN claimed
EP-4382546-A1 POLY(UREA-URETHANE) POLYMER BASF SE (DE) 2024-06-12 EP disclosed
WO-2024105027-A1 CLOSED LOOP RECYCLING CONCEPT FOR COMPOSITES COMPRISING COVALENT ADAPTABLE POLY(UREA-URETHANE) NETWORKS WITH DYNAMIC HINDERED UREA BONDS BASF SE (DE) 2024-05-23 WO disclosed
WO-2024105029-A1 RECYCLABLE POLY(UREA-URETHANE) POLYMER AND COMPOSITE WITH DYNAMIC HINDERED UREA BONDS (HUBS) BASF SE (DE) 2024-05-23 WO disclosed
WO-2024061814-A1 CONDITIONER WITH IMPROVED MANAGEABILITY WELLA GERMANY GMBH (DE) 2024-03-28 WO disclosed
EP-4342444-A1 CONDITIONER WITH IMPROVED MANAGEABILITY Wella Germany GmbH (DE) 2024-03-27 EP disclosed
EP-4334373-A1 TRIAZINE BASED ULTRAVOLET ABSORPTION POLYMER BASF SE (DE) 2024-03-13 EP disclosed
EP-4305085-A1 POLYUREA COPOLYMER BASF SE (DE) 2024-01-17 EP disclosed
WO-2023213785-A1 UV LIGHT STABILIZERS BASF SE (DE) 2023-11-09 WO disclosed
WO-2023161023-A1 ULTRAVIOLET ABSORBER BASF SE (DE) 2023-08-31 WO disclosed
US-4992534-A Anticarcinogenic agents with better water solubility, low toxicity, absorption and stability OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-12 US disclosed
US-4883800-A DIABETES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-11-28 US disclosed
US-4824834-A TREATING GOUT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1989-04-25 US disclosed
EP-0269859-A2 Pyrazolotriazine compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-06-08 EP disclosed
US-4734419-A Quinazoline derivatives, compositions thereof and their use in treating diabetic complications FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-03-29 US disclosed
EP-0247381-A2 5-flurorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-12-02 EP disclosed
EP-0218999-A2 New quinazoline derivatives, process for their production and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-04-22 EP disclosed
EP-0084941-B1 AMIDE DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-03-11 EP disclosed
US-4528382-A Imidoyl substituted pyrroles MCNEILAB, INC. (US) 1985-07-09 US disclosed