SCHEMBL7268836

SCHEMBL7268836

C[Si](C)(C)CCOC(=O)c1ccc(C2=C3C=CC(=N3)C(c3c(F)c(F)c(F)c(F)c3F)=C3C=CC(=N3)C(c3ccccc3)=C3C=CC(=N3)C(c3c(F)c(F)c(F)c(F)c3F)=C3C=CC2=N3)cc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ NPC1 O15118 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.33
▸ RARA P10276 1/20 0.33
▸ RARB P10826 1/20 0.33
▸ RARG P13631 1/20 0.33
▸ SLC1A5 Q15758 1/20 0.33
▸ F2RL3 Q96RI0 1/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ ESR2 Q92731 1/20 0.32

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
SCHEMBL6938681 0.92 — —
SCHEMBL6687802 0.78 RARA (0.51) LMNAKDM4ENPC1MAPTRAB9A
SCHEMBL6686810 0.74 TSHR (0.50) LMNAKDM4ENPC1MAPTRAB9A
SCHEMBL7266760 0.72 TOP1 (0.48) NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL25394857 0.70 NPC1 (0.47) KDM4ENPC1RAB9ASMN1; SMN2RARA
SCHEMBL483513 0.70 NPC1 (0.47) KDM4ENPC1RAB9ASMN1; SMN2RARA
SCHEMBL25395879 0.70 NPC1 (0.47) KDM4ENPC1RAB9ASMN1; SMN2RARA
SCHEMBL6910192 0.69 CA1 (0.46) LMNAKDM4ENPC1MAPTRAB9A
SCHEMBL27814178 0.68 MKNK1 (0.50) LMNAKDM4ENPC1MAPTRAB9A
SCHEMBL19718104 0.67 TSHR (0.42) LMNAKDM4EMAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6603070-B2 Convergent method for the synthesis of light harvesting rods. The rods are oligomers of the formula A1(Ab+1)b, wherein b is at least 1, A1 through Ab+1 are covalently coupled rod segments, and each rod segment A1 through A1+b comprises a NORTH CAROLINA STATE UNIVERSITY 2003-08-05 — — US disclosed
US-20030111108-A1 Convergent synthesis of multiporphyrin light-harvesting rods UNITED STATES DEPARTMENT OF ENERGY 2003-06-19 — — US disclosed
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