SCHEMBL22189059

SCHEMBL22189059

CCCCC(CC)Cn1cnc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 1/20 0.51
TDP1 Q9NUW8 1/20 0.50
GGPS1 O95749 1/20 0.49
FDPS P14324 1/20 0.49
AGER Q15109 5/20 0.46
CYP11B1 P15538 4/20 0.45
CYP11B2 P19099 4/20 0.45
TNF P01375 1/20 0.45
IDO1 P14902 1/20 0.45
LMNA P02545 4/20 0.45
HTT P42858 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
TSHR P16473 2/20 0.45
MAPT P10636 2/20 0.45
MAPK1 P28482 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
POLB P06746 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GAA P10253 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL1992186 0.89 APAF1 (0.51) APAF1TDP1GGPS1FDPSAGER
SCHEMBL28879025 0.89 APAF1 (0.51) APAF1TDP1GGPS1FDPSAGER
SCHEMBL9180561 0.89 APAF1 (0.51) APAF1TDP1GGPS1FDPSAGER
SCHEMBL1034854 0.89 APAF1 (0.51) APAF1TDP1GGPS1FDPSAGER
SCHEMBL9636144 0.83 TDP1 (0.44) APAF1TDP1GGPS1FDPSAGER
SCHEMBL30801385 0.82 APAF1 (0.41) APAF1TDP1GGPS1FDPSAGER
SCHEMBL8177049 0.78 APAF1 (0.49) APAF1TDP1GGPS1FDPSAGER
SCHEMBL27659956 0.78 AGER (0.56) APAF1TDP1GGPS1FDPSAGER
SCHEMBL13545635 0.77 APAF1 (0.61) APAF1TDP1GGPS1FDPSAGER
SCHEMBL15821807 0.77 ASAH1 (0.41) APAF1TDP1LMNAHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295368-A1 CATALYST FOR DISSOCIATION OF BLOCKING AGENT FOR BLOCKED ISOCYANATES, AND THERMOSETTING COMPOSITION CONTAINING SAID CATALYST FOR DISSOCIATION OF BLOCKING AGENT KOEI CHEMICAL COMPANY, LIMITED (JP) 2023-09-21 US disclosed
US-11718704-B2 Catalyst for dissociation of blocking agent for blocked isocyanates, and thermosetting composition containing said catalyst for dissociation of blocking agent KOEI CHEMICAL COMPANY, LIMITED (JP) 2023-08-08 US disclosed
CN-111094375-B Blocking agent dissociation catalyst for blocked isocyanate and thermosetting composition containing the same 广荣化学株式会社 2022-04-01 CN disclosed
EP-3689931-A1 CATALYST FOR DISSOCIATION OF BLOCKING AGENT FOR BLOCKED ISOCYANATES, AND THERMOSETTING COMPOSITION CONTAINING SAID CATALYST FOR DISSOCIATION OF BLOCKING AGENT Koei Chemical Company, Limited (JP) 2020-08-05 EP disclosed
US-20200216600-A1 CATALYST FOR DISSOCIATION OF BLOCKING AGENT FOR BLOCKED ISOCYANATES, AND THERMOSETTING COMPOSITION CONTAINING SAID CATALYST FOR DISSOCIATION OF BLOCKING AGENT KOEI CHEMICAL COMPANY, LIMITED (JP) 2020-07-09 US disclosed
CN-111094375-A Blocking agent dissociation catalyst for blocked isocyanate and thermosetting composition containing the same 广荣化学工业株式会社 2020-05-01 CN disclosed
CN-105705131-B Cosmetic or dermatological composition comprising a merocyanine and a UV-screening agent 莱雅公司 2019-12-17 CN disclosed
CN-105705131-A Cosmetic or dermatological composition comprising a merocyanine and an insoluble organic UV-screening agent and/or an insoluble inorganic UV-screening agent 莱雅公司 2016-06-22 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 (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-20230295368-A1 CATALYST FOR DISSOCIATION OF BLOCKING AGENT FOR BLOCKED ISOCYANATES, AND THERMOSETTING COMPOSITION CONTAINING SAID CATALYST FOR DISSOCIATION OF BLOCKING AGENT IDH3A, RCOR1, MUS81 APAF1 3455/4885TDP1 2293/4885GGPS1 2749/4885
US-11718704-B2 Catalyst for dissociation of blocking agent for blocked isocyanates, and thermosetting composition containing said catalyst for dissociation of blocking agent IDH3A, RCOR1, MUS81 APAF1 3455/4885TDP1 2293/4885GGPS1 2749/4885

“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.