SCHEMBL16846303

SCHEMBL16846303

O=C(c1ccc(F)nc1)N1CCC(N2CCc3ccccc3C2)CC1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADRA1A P35348 14/20 0.68
▸ HPGD P15428 1/20 0.52
▸ L3MBTL3 Q96JM7 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ HRH3 Q9Y5N1 1/20 0.46
▸ SLC18A3 Q16572 1/20 0.46

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
SCHEMBL16835561 0.88 ADRA1A (0.68) ADRA1AL3MBTL3L3MBTL1HRH3
SCHEMBL18143400 0.84 ADRA1A (0.70) ADRA1AHRH3
SCHEMBL16846280 0.81 ADRA1A (1.00) ADRA1AHPGD
SCHEMBL22418711 0.81 ADRA1A (0.61) ADRA1AL3MBTL3L3MBTL1
SCHEMBL30823775 0.81 ADRA1A (0.61) ADRA1AL3MBTL3L3MBTL1
SCHEMBL18143544 0.81 ADRA1A (0.86) ADRA1AHPGDL3MBTL3L3MBTL1
SCHEMBL16846289 0.81 ADRA1A (1.00) ADRA1AHPGD
SCHEMBL23553504 0.80 ADRA1A (0.60) ADRA1AHPGDL3MBTL3L3MBTL1
SCHEMBL16846245 0.79 ADRA1A (1.00) ADRA1A
SCHEMBL16846262 0.79 ADRA1A (1.00) ADRA1AHPGDL3MBTL3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9624198-B2 Substituted piperidinyltetrahydroquinolines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-04-18 — — US disclosed
US-9624198-B2 Substituted piperidinyltetrahydroquinolines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-04-18 — — US disclosed
US-9624198-B2 Substituted piperidinyltetrahydroquinolines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-04-18 — — US disclosed
US-20160304491-A1 SUBSTITUTED PIPERIDINYLTETRAHYDROQUINOLINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-10-20 — — US disclosed
US-20160304491-A1 SUBSTITUTED PIPERIDINYLTETRAHYDROQUINOLINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-10-20 — — US disclosed
US-20160304491-A1 SUBSTITUTED PIPERIDINYLTETRAHYDROQUINOLINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-10-20 — — US disclosed
WO-2015091417-A1 SUBSTITUTED PIPERIDINYL-TETRAHYDROQUINOLINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-06-25 — — WO 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-20160304491-A1 SUBSTITUTED PIPERIDINYLTETRAHYDROQUINOLINES TNNI3, TNNC1, PRPH ADRA1A 1949/4885HPGD 2740/4885L3MBTL3 2466/4885

“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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