SCHEMBL21179825

SCHEMBL21179825

OC1Cc2ccccc2N1C1CCNCC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 14/20 0.56
▸ HTR2A P28223 10/20 0.56
▸ HTR2B P41595 7/20 0.46
▸ NOTUM Q6P988 1/20 0.37
▸ HTR1A P08908 1/20 0.36
▸ HTR7 P34969 1/20 0.36
▸ HTR5A P47898 1/20 0.36
▸ HTR6 P50406 1/20 0.36
▸ ADRB1 P08588 1/20 0.35
▸ PARP1 P09874 1/20 0.35

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
SCHEMBL18413086 0.81 HTR2A (0.42) HTR2CHTR2AHTR2BNOTUM
Hydrochloric Acid SCHEMBL27555071 0.76 HTR2C (0.44) HTR2CHTR2AHTR2BPARP1
SCHEMBL27716469 0.74 HTR2C (0.45) HTR2CHTR2AHTR2BPARP1
SCHEMBL6713653 0.72 HTR2C (1.00) HTR2CHTR2AHTR2B
SCHEMBL14540409 0.71 HTR2C (0.43) HTR2CHTR2AHTR2B
SCHEMBL27569386 0.70 HTR2C (0.51) HTR2CHTR2AHTR2BNOTUM
SCHEMBL2869637 0.69 HTR2C (0.58) HTR2CHTR2AHTR2BNOTUMHTR1A
SCHEMBL18175772 0.69 HTR2C (0.53) HTR2CHTR2AHTR2BADRB1
SCHEMBL11102106 0.68 HTR2C (0.45) HTR2CHTR2AHTR2BHTR6ADRB1
SCHEMBL1673259 0.67 AADAT (0.46) HTR2CHTR2AHTR2BNOTUM

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-10358432-B2 Piperdinyl nociceptin receptor compounds ASTRAEA THERAPEUTICS, LLC (US) 2019-07-23 — — 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 (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-10358432-B2 Piperdinyl nociceptin receptor compounds OPRL1, OPRK1, OPRD1 HTR2C 71/4885HTR2A 42/4885HTR2B 93/4885

“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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