SCHEMBL29307769

SCHEMBL29307769

CCCCCOc1cc2c3cc(OCCCCC)c(OCCCCC)cc3c3c(cc(OCCCCC)c4oc(-c5ccc6ccccc6c5)nc43)c2cc1OCCCCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 5/20 0.41
▸ S1PR1 P21453 1/20 0.41
▸ MCHR1 Q99705 2/20 0.38
▸ TLR8 Q9NR97 2/20 0.38
▸ BCHE P06276 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ MAPT P10636 2/20 0.37
▸ ESR1 P03372 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ UTRN P46939 3/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ AHR P35869 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HSD17B10 Q99714 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
SCHEMBL29307768 0.97 PTPN1 (0.41) PTPN1S1PR1MCHR1TLR8BCHE
SCHEMBL29307784 0.97 PTPN1 (0.44) PTPN1S1PR1MCHR1TLR8BCHE
SCHEMBL29307771 0.89 BCHE (0.39) PTPN1MCHR1TLR8BCHEACHE
SCHEMBL29307776 0.86 MAPT (0.39) PTPN1MCHR1TLR8BCHEACHE
SCHEMBL29307767 0.85 TLR8 (0.39) PTPN1MCHR1TLR8MAPTCYP1A2
SCHEMBL29307775 0.84 MAPT (0.36) MCHR1TLR8BCHEACHEMAPT
SCHEMBL29307786 0.83 PTPN1 (0.37) PTPN1TLR8MAPTESR1ESR2
SCHEMBL29307770 0.83 ALOX15 (0.42) S1PR1MCHR1TLR8MAPTALDH1A1
SCHEMBL29307777 0.81 PTPN11 (0.36) MCHR1TLR8BCHEACHEMAPT
SCHEMBL29307844 0.81 RAC1 (0.47) S1PR1MAPTESR1ESR2CYP1A2

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-12041850-B2 Luminescent compounds Chromatwist Limited (GB) 2024-07-16 — — 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-12041850-B2 Luminescent compounds AHR, ARNT, CYCS PTPN1 2414/4885S1PR1 3948/4885MCHR1 757/4885

“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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