SCHEMBL19972034

SCHEMBL19972034

CCCc1ccc(CCC)c(O)c1N

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.48
ELANE P08246 3/20 0.44
CTSG P08311 2/20 0.44
TYR P14679 2/20 0.40
IAPP P10997 3/20 0.38
GABRA1 P14867 4/20 0.36
GABRB2 P47870 4/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
HMGCR P04035 1/20 0.35
ALOX5 P09917 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
SCHEMBL5590177 0.83 PRKCI (0.57) PRKCIELANECTSGTYRIAPP
SCHEMBL27454188 0.77 PRKCI (0.44) PRKCIELANECTSGTYRHMGCR
SCHEMBL16527925 0.76 PRKCI (0.52) PRKCIELANECTSGTYRIAPP
SCHEMBL5196215 0.76 PRKCI (0.57) PRKCIELANECTSGTYRIAPP
SCHEMBL9505579 0.76 GABRA1 (0.54) PRKCIGABRA1GABRB2
SCHEMBL10438966 0.76 IAPP (0.44) PRKCIELANECTSGIAPPGABRA1
SCHEMBL2034606 0.75 TYR (0.52) PRKCIELANECTSGTYRIAPP
SCHEMBL23387422 0.74 TYR (0.55) PRKCIELANECTSGTYRIAPP
SCHEMBL5445936 0.74 PRKCI (0.60) PRKCIELANECTSGTYRIAPP
SCHEMBL28762559 0.74 PRKCI (0.50) PRKCIELANECTSGTYRIAPP

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-9957241-B2 Aromatic diamine, an intermediate therefor, a method for producing the aromatic diamine, and a method for producing the intermediate therefor SEIKA CORPORATION (JP) 2018-05-01 US disclosed
US-20180079732-A1 AROMATIC DIAMINE, AN INTERMEDIATE THEREFOR, A METHOD FOR PRODUCING THE AROMATIC DIAMINE, AND A METHOD FOR PRODUCING THE INTERMEDIATE THEREFOR SEIKA CORPORATION (JP) 2018-03-22 US disclosed
CN-107531652-A Aromatic diamine, intermediate thereof, and processes for producing these 精化株式会社 2018-01-02 CN 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-20180079732-A1 AROMATIC DIAMINE, AN INTERMEDIATE THEREFOR, A METHOD FOR PRODUCING THE AROMATIC DIAMINE, AND A METHOD FOR PRODUCING THE INTERMEDIATE THEREFOR WEE1, WEE2, WASF2 PRKCI 4282/4885ELANE 4777/4885CTSG 4662/4885

“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.