SCHEMBL10477477

SCHEMBL10477477

O=C(n1ccc2ccccc21)n1ccc2ccccc21

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.70
TSHR P16473 2/20 0.66
RAB9A P51151 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
KMT2A Q03164 2/20 0.50
TFPI2 P48307 1/20 0.47
NPY4R P50391 1/20 0.47
GAA P10253 1/20 0.47
LMNA P02545 2/20 0.46
HTR3E A5X5Y0 1/20 0.45
HTR3B O95264 1/20 0.45
CHRNB2 P17787 1/20 0.45
CHRNA7 P36544 1/20 0.45
CHRNA4 P43681 1/20 0.45
HTR3A P46098 1/20 0.45
HTR3D Q70Z44 1/20 0.45
HTR3C Q8WXA8 1/20 0.45
CDK4 P11802 4/20 0.45
CCND1 P24385 4/20 0.45
MAPK1 P28482 1/20 0.42

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
SCHEMBL1151123 0.86 NOTUM (0.70) NOTUMTSHRRAB9AL3MBTL1KMT2A
SCHEMBL931955 0.84 TSHR (0.69) NOTUMTSHRRAB9AL3MBTL1KMT2A
SCHEMBL29453277 0.84 TSHR (0.69) NOTUMTSHRRAB9AL3MBTL1KMT2A
SCHEMBL5638317 0.83 NOTUM (0.66) NOTUMTSHRRAB9AL3MBTL1KMT2A
SCHEMBL6628956 0.83 TSHR (0.67) NOTUMTSHRRAB9AL3MBTL1KMT2A
SCHEMBL4520021 0.83 NOTUM (0.66) NOTUMTSHRRAB9AL3MBTL1KMT2A
SCHEMBL15702556 0.83 NOTUM (0.66) NOTUMTSHRRAB9AL3MBTL1KMT2A
Bromide SCHEMBL19150274 0.83 TSHR (0.67) NOTUMTSHRRAB9AL3MBTL1KMT2A
Hydrochloric Acid SCHEMBL20610213 0.83 TSHR (0.67) NOTUMTSHRRAB9AL3MBTL1KMT2A
SCHEMBL3649822 0.83 NOTUM (0.66) NOTUMTSHRRAB9AL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0265495-A4 BONDED PHASE CHROMATOGRAPHIC SUPPORTS. ANALYTICHEM INT INC (US) 1988-11-23 EP claimed
EP-0265495-A1 BONDED PHASE CHROMATOGRAPHIC SUPPORTS ANALYTICHEM INTERNATIONAL, INC. (US) 1988-05-04 EP claimed
WO-1987006586-A1 BONDED PHASE CHROMATOGRAPHIC SUPPORTS ANALYTICHEM INTERNATIONAL, INC. (US) 1987-11-05 WO claimed
WO-2020192927-A1 LITHIUM BATTERY AND USE OF A UREA-BASED ADDITIVE AS AN ELECTROLYTE ADDITIVE CONTAINED THEREIN BAYERISCHE MOTOREN WERKE AKTIENGESELLSCHAFT (DE) 2020-10-01 WO disclosed
US-4837348-A Bonded phase chromatographic supports VARIAN ASSOCIATES, INC. (US) 1989-06-06 US disclosed
EP-0265495-A4 BONDED PHASE CHROMATOGRAPHIC SUPPORTS. ANALYTICHEM INT INC (US) 1988-11-23 EP disclosed
EP-0265495-A1 BONDED PHASE CHROMATOGRAPHIC SUPPORTS ANALYTICHEM INTERNATIONAL, INC. (US) 1988-05-04 EP disclosed
WO-1987006586-A1 BONDED PHASE CHROMATOGRAPHIC SUPPORTS ANALYTICHEM INTERNATIONAL, INC. (US) 1987-11-05 WO disclosed