SCHEMBL14732107

SCHEMBL14732107

CCn1c(CNc2cccc(C(F)(F)F)c2)nnc1Sc1ccc2ccccc2c1NC(C)=O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 1/20 0.45
▸ SLC27A1 Q6PCB7 5/20 0.45
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.43
▸ TSHR P16473 3/20 0.42
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 3/20 0.39
▸ USP2 O75604 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ ROCK2 O75116 1/20 0.39
▸ GRK2 P25098 1/20 0.39

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
SCHEMBL14732160 0.88 TSHR (0.54) SLC27A1ALDH1A1TSHRLMNASMN1; SMN2
SCHEMBL14732175 0.83 KMT2A (0.43) SLC27A1MEN1KMT2AALDH1A1TSHR
SCHEMBL14732106 0.79 SMN1; SMN2 (0.61) RORCSLC27A1MEN1KMT2AALDH1A1
SCHEMBL14732085 0.78 L3MBTL1 (0.51) MEN1KMT2AALDH1A1TSHRLMNA
SCHEMBL4202684 0.72 LMNA (0.73) SLC27A1MEN1KMT2AALDH1A1KDM4E
SCHEMBL6406472 0.69 LMNA (0.52) RORCSLC27A1MEN1KMT2AALDH1A1
SCHEMBL14732159 0.66 SMN1; SMN2 (0.67) RORCSLC27A1MEN1KMT2AALDH1A1
SCHEMBL14732174 0.63 SMN1; SMN2 (0.63) RORCSLC27A1MEN1KMT2AALDH1A1
SCHEMBL14732156 0.62 SMN1; SMN2 (0.63) RORCSLC27A1MEN1KMT2AALDH1A1
SCHEMBL505220 0.62 RXFP1 (0.69) MEN1KMT2AALDH1A1KDM4ELMNA

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-8389739-B1 Modulators of retinoid-related orphan receptor gamma Orphagen Pharmaceuticals (US) 2013-03-05 — — US disclosed
Send feedback