SCHEMBL30504178

SCHEMBL30504178

CCCCCOc1ccc(-c2ccc(-c3ccc(OC)cc3OCCCCCCN)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.45
▸ RARB P10826 3/20 0.45
▸ PTPN11 Q06124 2/20 0.44
▸ CYP11B1 P15538 1/20 0.44
▸ CYP11B2 P19099 1/20 0.44
▸ NR5A1 Q13285 1/20 0.42
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ ITGB3 P05106 1/20 0.41
▸ ITGA2B P08514 1/20 0.41
▸ HTR2A P28223 2/20 0.40
▸ HTR2C P28335 2/20 0.40
▸ HTR1B P28222 1/20 0.40
▸ HTR2B P41595 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ AHR P35869 1/20 0.40
▸ CNR1 P21554 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ CYSLTR2 Q9NS75 1/20 0.39
▸ CYSLTR1 Q9Y271 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
SCHEMBL30504175 1.00 SYK (0.45) SYKRARBPTPN11CYP11B1CYP11B2
SCHEMBL20928525 1.00 SYK (0.45) SYKRARBPTPN11CYP11B1CYP11B2
SCHEMBL20928526 1.00 SYK (0.45) SYKRARBPTPN11CYP11B1CYP11B2
SCHEMBL20928535 0.99 SYK (0.46) SYKRARBPTPN11CYP11B1CYP11B2
SCHEMBL30504169 0.99 SYK (0.46) SYKRARBPTPN11CYP11B1CYP11B2
SCHEMBL20928528 0.96 SYK (0.46) SYKRARBPTPN11CYP11B1CYP11B2
SCHEMBL30745239 0.96 SYK (0.46) SYKRARBPTPN11CYP11B1CYP11B2
SCHEMBL30504170 0.94 SYK (0.46) SYKRARBPTPN11CYP11B1CYP11B2
SCHEMBL20928544 0.94 SYK (0.46) SYKRARBPTPN11CYP11B1CYP11B2
SCHEMBL20928532 0.94 PTPN11 (0.49) RARBPTPN11NR5A1CYP3A4CYP2D6

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-11891558-B2 Solid foam comprising mesogenic ligand-functionalized nanoparticles and methods of making and using the same THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-02-06 — — US disclosed
US-11708530-B2 Organic ligands for templatable mesoscale nanocapsules THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-07-25 — — 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-11708530-B2 Organic ligands for templatable mesoscale nanocapsules EPCAM, L1CAM, ICOSLG SYK 1626/4885RARB 1796/4885PTPN11 854/4885

“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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