SCHEMBL14996508

SCHEMBL14996508

Cc1cc(N2CCC3(CCN(C)C3)CC2)ccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRDM9 Q9NQV7 1/20 0.42
▸ PRDM7 Q9NQW5 1/20 0.42
▸ LRRK2 Q5S007 3/20 0.42
▸ HRH4 Q9H3N8 4/20 0.41
▸ TLR9 Q9NR96 2/20 0.40
▸ TLR8 Q9NR97 2/20 0.40
▸ TLR7 Q9NYK1 2/20 0.40
▸ TMEM97 Q5BJF2 1/20 0.40
▸ OGA O60502 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SOS1 Q07889 1/20 0.38
▸ TSHR P16473 3/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ ACVR1 Q04771 1/20 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
SCHEMBL30306686 0.84 LRRK2 (0.47) LRRK2TMEM97OGAMEN1KMT2A
SCHEMBL13168224 0.82 OGA (0.46) PRDM9PRDM7LRRK2TMEM97OGA
SCHEMBL13131094 0.82 PRDM9 (0.40) PRDM9PRDM7LRRK2HRH4TMEM97
SCHEMBL14996505 0.81 OGA (0.43) LRRK2TMEM97OGAMEN1KMT2A
SCHEMBL14996495 0.81 AR (0.43) HRH4SOS1TSHRCYP2D6CYP2C9
SCHEMBL14996530 0.80 CYP2C9 (0.56) MEN1KMT2ATSHRCYP2D6CYP2C9
SCHEMBL13027974 0.79 HRH4 (0.61) HRH4MEN1GLAGAAKMT2A
SCHEMBL21186191 0.79 HRH4 (0.50) PRDM9PRDM7HRH4MEN1GLA
SCHEMBL13131256 0.77 SLC6A2 (0.44) TLR9TLR8TLR7MEN1KMT2A
Hydrochloric Acid SCHEMBL2816087 0.76 SLC6A2 (0.44) TLR9TLR8TLR7MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130231327-A1 Substituted Spiro-Amide Compounds GRUENENTHAL GMBH (DE) 2013-09-05 — — US disclosed
US-8455475-B2 Substituted spiro-amide compounds GRUENENTHAL GMBH (DE) 2013-06-04 — — 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-20130231327-A1 Substituted Spiro-Amide Compounds BDKRB1, BDKRB2, REN PRDM9 2694/4885PRDM7 4132/4885LRRK2 322/4885

“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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