SCHEMBL13502087

SCHEMBL13502087

CCCCCOc1cc2c3cc(OCCCCC)c(C)cc3p(Oc3ccccc3)c2cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 2/20 0.43
▸ S1PR5 Q9H228 2/20 0.40
▸ GAA P10253 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ KCNA3 P22001 2/20 0.38
▸ CNR1 P21554 3/20 0.38
▸ CNR2 P34972 2/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ MCHR1 Q99705 1/20 0.36
▸ TLR8 Q9NR97 1/20 0.36
▸ ESR1 P03372 3/20 0.36
▸ GPBAR1 Q8TDU6 1/20 0.36
▸ PLA2G2A P14555 1/20 0.36
▸ MLNR O43193 1/20 0.36
▸ NR1I2 O75469 1/20 0.36
▸ NR3C1 P04150 1/20 0.36
▸ PGR P06401 1/20 0.36
▸ ADRB2 P07550 1/20 0.36

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
SCHEMBL13502085 0.80 ESR1 (0.38) S1PR5GAATDP1L3MBTL1MCHR1
SCHEMBL12743780 0.80 S1PR5 (0.41) LTA4HS1PR5GAATDP1L3MBTL1
SCHEMBL13502053 0.80 S1PR5 (0.41) LTA4HS1PR5GAATDP1L3MBTL1
SCHEMBL12593219 0.78 S1PR5 (0.39) LTA4HS1PR5GAATDP1L3MBTL1
SCHEMBL13502091 0.77 S1PR5 (0.36) LTA4HS1PR5GAATDP1L3MBTL1
SCHEMBL13502329 0.77 GAA (0.42) LTA4HS1PR5GAATDP1L3MBTL1
SCHEMBL13502195 0.74 LTA4H (0.43) LTA4HS1PR5KCNA3CNR1TSHR
SCHEMBL6002987 0.74 TLR8 (0.56) LTA4HGAATDP1L3MBTL1CNR1
SCHEMBL13502081 0.73 ESR1 (0.40) S1PR5MCHR1TLR8ESR1NR1I2
SCHEMBL13502082 0.73 THRB (0.40) S1PR5GAAMCHR1ESR1

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-7662478-B2 Polymer and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-02-16 — — US disclosed
US-20080103278-A1 NEW POLYMER AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED 2008-05-01 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080103278-A1 NEW POLYMER AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME CRY1, ARCN1, CORO1A LTA4H 1839/4885S1PR5 3816/4885GAA 2007/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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