SCHEMBL22246993

SCHEMBL22246993

Cc1ccc(N(c2ccc(C)c(C)c2)c2cc3c4cccc(N(c5ccc(C)c(C)c5)c5ccc(C)c(C)c5)c4ccc3c3ccccc23)cc1C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.35
GAA P10253 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL1376567 0.93 CYP1A2 (0.38) S1PR1CYP1A2
SCHEMBL13775273 0.92 KIF11 (0.34) S1PR1GAACYP1A2
SCHEMBL13775185 0.91 KIF11 (0.33) S1PR1GAACYP1A2
SCHEMBL20115617 0.89 CYP1A2 (0.39) S1PR1CYP1A2
SCHEMBL18978244 0.89 S1PR1 (0.36) S1PR1CYP1A2
SCHEMBL10053538 0.88 ALDH1A1 (0.42) CYP1A2
SCHEMBL23334227 0.87 MAPT (0.37) S1PR1CYP1A2
SCHEMBL2544680 0.87 CYP1A2 (0.33) S1PR1CYP1A2
SCHEMBL2541698 0.87 MAPT (0.37) S1PR1CYP1A2
SCHEMBL8322304 0.87 S1PR1 (0.40) S1PR1GAACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230014964-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2023-01-19 US disclosed
US-11387414-B2 Spirobifluorene compounds for organic electroluminescent devices MERCK PATENT GMBH (DE) 2022-07-12 US disclosed
US-20200235305-A1 SPIROBIFLUORENE COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-07-23 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 (3 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-20230014964-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC APPARATUS ZYX, ZKSCAN2, ZFX S1PR1 4770/4885GAA 1743/4885CYP1A2 691/4885
US-11387414-B2 Spirobifluorene compounds for organic electroluminescent devices PKD1, PIEZO1, AQP1 S1PR1 1294/4885GAA 3569/4885CYP1A2 852/4885
US-20200235305-A1 SPIROBIFLUORENE COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES PKD1, PIEZO1, AQP1 S1PR1 1499/4885GAA 3248/4885CYP1A2 665/4885

“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.