SCHEMBL14230076

SCHEMBL14230076

Oc1ccc(Oc2ccc(CCNCl)cc2)cc1I

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 8/20 0.46
▸ PCNA P12004 6/20 0.46
▸ THRA P10827 6/20 0.46
▸ POLB P06746 3/20 0.46
▸ HIF1A Q16665 3/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ LMNA P02545 4/20 0.45
▸ ABCB11 O95342 2/20 0.45
▸ GABRA1 P14867 2/20 0.45
▸ PPARG P37231 2/20 0.45
▸ GABRA2 P47869 2/20 0.45
▸ GABRB2 P47870 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ PGR P06401 1/20 0.45
▸ CHRM2 P08172 1/20 0.45
▸ HTR1A P08908 1/20 0.45
▸ ADRA2A P08913 1/20 0.45

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
SCHEMBL14230053 0.87 PPARG (0.39) THRBPCNATHRAPPARGRXRA
SCHEMBL14230044 0.86 TAAR5 (0.51) THRBPCNATHRAPOLBHIF1A
SCHEMBL14230042 0.86 PCNA (0.64) THRBPCNATHRAPOLBHIF1A
SCHEMBL13886595 0.80 TAAR1 (0.56) THRBPCNATHRAPOLBHIF1A
SCHEMBL14230075 0.79 ESR1 (0.52) IGF1RALOX15MEN1KMT2AADRB2
SCHEMBL14575001 0.77 THRB (0.54) THRBPCNATHRAPOLBHIF1A
SCHEMBL13886704 0.76 CA2 (0.47) THRBPCNATHRAPOLBHIF1A
SCHEMBL14230065 0.74 TAAR5 (0.68) PCNAPPARG
SCHEMBL15684799 0.74 LTA4H (0.54) PPARGSMN1; SMN2CYP1A2IGF1RALOX15
SCHEMBL14230070 0.73 PCNA (0.62) THRBPCNATHRAPOLBHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7355079-B2 Thyronamine derivatives and analogs and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-04-08 — — US disclosed
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