SCHEMBL11856807

SCHEMBL11856807

CN1C(=O)C2CCCN2C(=O)c2cc(Cl)ccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ PDE3A Q14432 1/20 0.42
▸ CHRM2 P08172 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ POLB P06746 3/20 0.40
▸ GAA P10253 1/20 0.40
▸ TSPO P30536 1/20 0.40
▸ HTR2A P28223 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ GABRP O00591 2/20 0.38
▸ GABRD O14764 2/20 0.38
▸ GABRA1 P14867 2/20 0.38
▸ GABRB1 P18505 2/20 0.38
▸ GABRG2 P18507 2/20 0.38
▸ GABRB3 P28472 2/20 0.38
▸ GABRA5 P31644 2/20 0.38

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
SCHEMBL11866150 0.90 ALDH1A1 (0.42) POLBGAAHTR2AHTR2CHTR2B
SCHEMBL11860611 0.85 KMT2A (0.45) LMNAPOLBGAAHTR2AHTR2C
SCHEMBL11782432 0.84 DDB1 (0.40) LMNAPOLBTP53GABRA1GABRG2
SCHEMBL11873109 0.84 GABRG2 (0.51) LMNAPOLBTP53GABRA1GABRG2
SCHEMBL11868087 0.81 KMT2A (0.49) GAAHTR2AHTR2CHTR2BGABRG2
SCHEMBL7580646 0.81 POLB (0.56) LMNACHRM2ADRA2APOLBGAA
SCHEMBL7573030 0.80 CASP1 (0.53) OPRK1LMNAGAAGABRA1GABRG2
SCHEMBL11869300 0.79 POLB (0.40) POLBALDH1A1HPGD
SCHEMBL14288831 0.77 POLB (0.58) LMNAPOLBGAATP53GABRA1
SCHEMBL11868238 0.75 GRIA1 (0.43) LMNAPOLBGAATP53ALDH1A1

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-20080027038-A1 N-Acylated lipophilic amino acid derivatives KAKEN PHARMACEUTICAL CO., LTD. (JP) 2008-01-31 — — US disclosed
US-20080027038-A1 N-Acylated lipophilic amino acid derivatives KAKEN PHARMACEUTICAL CO., LTD. (JP) 2008-01-31 — — US disclosed
US-3947408-A ANTIANXIETY AGENTS AMERICAN CYANAMID COMPANY (US) 1976-03-30 — — 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-20080027038-A1 N-Acylated lipophilic amino acid derivatives GHRHR, NPPA, SSTR5 OPRK1 1000/4885LMNA 1434/4885PDE3A 1789/4885

“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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