SCHEMBL4846134

SCHEMBL4846134

ICCCCCCCCc1cccs1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.57
TSHR P16473 2/20 0.50
ADRA2A P08913 3/20 0.43
ADRA2B P18089 3/20 0.43
ADRA2C P18825 3/20 0.43
NPC1 O15118 2/20 0.43
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 0.40
PTGS2 P35354 1/20 0.40
RAB9A P51151 1/20 0.39
CYP2C19 P33261 1/20 0.37
USP2 O75604 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
SCHEMBL9996556 0.98 TAAR1 (0.59) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL3583815 0.91
SCHEMBL6734915 0.89 TAAR1 (0.70) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL7116263 0.89 TAAR1 (0.70) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL8571535 0.89 TAAR1 (0.70) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL20146704 0.87 TAAR1 (0.73) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL920218 0.83 TAAR1 (0.57) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL921561 0.83 TAAR1 (0.57) TAAR1TSHRADRA2AADRA2BADRA2C
SCHEMBL633673 0.82
SCHEMBL20135772 0.82 TAAR1 (0.73) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7463400-B1 Electrochromic display device FUJI XEROX CO., LTD. (JP) 2008-12-09 US disclosed
US-6284365-B1 FOR CONTROLLING PHYSICAL PROPERTIES OF SURFACE AND INTERFACE OF SOLID ARTICLE SUCH AS WETTABILITY, ADHESIVE PROPERTY, SURFACE ENERGY, DISPERSABILITY, CHEMICAL RESISTANCE FUJI XEROX CO., LTD. (JP) 2001-09-04 US disclosed
US-6028265-A SEMICONDUCTOR, COMPOSITE FILM OF DYE FUJI XEROX CO., LTD. (JP) 2000-02-22 US disclosed