SCHEMBL5677258

SCHEMBL5677258

N#CC1=Cc2ccccc2[C]c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.50

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
SCHEMBL3946811 0.78 GPR84 (0.62) GPR84
Ethyne SCHEMBL28448752 0.74 GPR84 (0.58) GPR84
SCHEMBL5675901 0.71 MEN1 (0.32)
Ammonia Solution, Strong SCHEMBL3949938 0.69 GPR84 (0.53) GPR84
SCHEMBL5677598 0.68 PTPN1 (0.40)
SCHEMBL102781 0.67 MEN1 (0.37)
SCHEMBL2781483 0.67 GPR84 (0.50) GPR84
SCHEMBL29624824 0.67 GPR84 (0.50) GPR84
SCHEMBL11486708 0.67 GPR84 (0.50) GPR84
SCHEMBL6371108 0.67 GPR84 (0.50) GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060036109-A1 Tropylideneamines and use thereof LANXESS DEUTSCHLAND GMBH (DE) 2006-02-16 US disclosed
EP-1614674-A2 Tropylideneamines and their use Lanxess Deutschland GmbH (DE) 2006-01-11 EP disclosed
US-20050283014-A1 Bistropylidenediamines and use thereof LANXESS DEUTSCHLAND GMBH (DE) 2005-12-22 US disclosed
EP-1604973-A1 Bistropylidenediamines and their use Lanxess Deutschland GmbH (DE) 2005-12-14 EP 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 (2 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-20060036109-A1 Tropylideneamines and use thereof PNMT, INMT, HNMT GPR84 2068/4885
US-20050283014-A1 Bistropylidenediamines and use thereof FHIT, BTD, HNMT GPR84 2275/4885

“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.