SCHEMBL20376506

SCHEMBL20376506

C[C@H](N)c1ccc(F)c(OCCC2C[C@H]2C)c1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 8/20 0.35
▸ HTR2B P41595 8/20 0.35
▸ HTR2A P28223 7/20 0.35
▸ AKT1 P31749 3/20 0.32
▸ RPS6KA1 Q15418 3/20 0.32
▸ PRKCA P17252 1/20 0.32
▸ GRK2 P25098 1/20 0.32
▸ GRM2 Q14416 1/20 0.31
▸ GRM3 Q14832 1/20 0.31

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
SCHEMBL20207075 1.00 HTR2C (0.35) HTR2CHTR2BHTR2AAKT1RPS6KA1
SCHEMBL18374371 0.84 SCN9A (0.42) —
Hydrochloric Acid SCHEMBL20191183 0.83 SCN9A (0.41) —
Hydrochloric Acid SCHEMBL20191182 0.83 SCN9A (0.41) —
SCHEMBL20188092 0.79 MAPT (0.39) HTR2CHTR2BHTR2A
SCHEMBL18374263 0.79 MAPT (0.39) HTR2CHTR2BHTR2A
Hydrochloric Acid SCHEMBL20338506 0.77 KDM4E (0.41) HTR2CHTR2BHTR2A
Hydrochloric Acid SCHEMBL20338505 0.77 KDM4E (0.41) HTR2CHTR2BHTR2A
SCHEMBL28408399 0.75 HTT (0.44) —
SCHEMBL31447482 0.75 HTT (0.44) —

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-10858344-B2 Hydantoin containing deoxyuridine triphosphatase inhibitors CV6 THERAPEUTICS (NI) LIMITED (GB) 2020-12-08 — — US disclosed
WO-2018128720-A1 URACIL CONTAINING COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-07-12 — — WO disclosed
US-9277619-B2 Light emitting layer-forming solid material, organic electroluminescent device and method for producing the same UDC Ireland (IE) 2016-03-01 — — 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-10858344-B2 Hydantoin containing deoxyuridine triphosphatase inhibitors DUT, TYMP, DPYD HTR2C 2804/4885HTR2B 2876/4885HTR2A 3172/4885

“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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