SCHEMBL1898619

SCHEMBL1898619

CCCCCCCCCCCCn1cc[n+](CCCCCCCCCCCC)c1C

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 6/20 0.77
▸ CA2 P00918 6/20 0.77
▸ MEN1 O00255 4/20 0.66
▸ KMT2A Q03164 4/20 0.66
▸ EEF2K O00418 2/20 0.66
▸ EEF2 P13639 2/20 0.66
▸ PLK4 O00444 1/20 0.66
▸ JAK2 O60674 1/20 0.66
▸ EGFR P00533 1/20 0.66
▸ TYK2 P29597 1/20 0.66
▸ FLT3 P36888 1/20 0.66
▸ BLM P54132 1/20 0.66
▸ ITK Q08881 1/20 0.66
▸ PIM2 Q9P1W9 1/20 0.66
▸ HTT P42858 4/20 0.43
▸ MAPT P10636 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40

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
SCHEMBL5292942 1.00 CA1 (0.77) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5818246 1.00 CA1 (0.77) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5289428 1.00 CA1 (0.77) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5298822 1.00 CA1 (0.77) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5300488 1.00 CA1 (0.77) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5301675 1.00 CA1 (0.77) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5326355 1.00 CA1 (0.77) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5290185 1.00 CA1 (0.77) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5290881 1.00 CA1 (0.77) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5296208 1.00 CA1 (0.77) CA1CA2MEN1KMT2AEEF2K

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
EP-1698606-B1 FLUORINATING AGENT AND METHOD FOR PRODUCING FLUORINE-CONTAINING COMPOUND USING SAME SUMITOMO CHEMICAL CO (JP) 2013-02-20 — — EP disclosed
US-7939697-B2 Fluorinating agent and method for producing fluorine-containing compound using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-10 — — US disclosed
US-20090287025-A1 Fluorinating agent and method for producing fluorine-containing compound using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2009-11-19 — — US disclosed
US-7569703-B2 Fluorinating agent and method for producing fluorine-containing compound using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-08-04 — — US disclosed
US-20070135634-A1 Fluorinating agent and method for producing fluorine-containing compound using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2007-06-14 — — US disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 — — WO disclosed
EP-1698606-A1 FLUORINATING AGENT AND METHOD FOR PRODUCING FLUORINE-CONTAINING COMPOUND USING SAME Sumitomo Chemical Company, Limited (JP) 2006-09-06 — — 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-20070135634-A1 Fluorinating agent and method for producing fluorine-containing compound using the same AFF1, AFF2, AFF4 CA1 1396/4885CA2 1758/4885MEN1 86/4885
US-20090287025-A1 Fluorinating agent and method for producing fluorine-containing compound using the same AFF1, AFF2, AFF4 CA1 1396/4885CA2 1758/4885MEN1 86/4885

“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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