SCHEMBL2679796

SCHEMBL2679796

Cc1nccn1C(F)(F)C(F)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
POLB P06746 1/20 0.31

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
SCHEMBL28036586 0.76 ALDH1A1 (0.36) ALDH1A1KMT2AKDM4EMEN1HPGD
Ammonia Solution, Strong SCHEMBL29243780 0.74 ALDH1A1 (0.35) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL2514772 0.68 CYP2E1 (0.33) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL17616423 0.67 ALDH1A1 (0.33) ALDH1A1KMT2APOLB
Perchlorate SCHEMBL30215899 0.67 ALDH1A1 (0.35) ALDH1A1KMT2AKDM4EPOLB
SCHEMBL19622429 0.66 KMT2A (0.35) ALDH1A1KMT2APOLB
SCHEMBL422557 0.66 ACHE (0.33)
SCHEMBL23867480 0.65 FDPS (0.38) ALDH1A1KMT2APOLB
SCHEMBL22672901 0.63 ALDH1A1 (0.34) ALDH1A1KMT2APOLB
SCHEMBL14459642 0.63 ALDH1A1 (0.41) ALDH1A1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8637601-B2 Fluorine-containing polymer having heteroaromatic ring DAIKIN INDUSTRIES, LTD. (JP) 2014-01-28 US disclosed
EP-1983008-B1 FLUORINE-CONTAINING POLYMER CONTAINING HETEROAROMATIC RING DAIKIN IND LTD (JP) 2012-12-26 EP disclosed
US-20120271005-A1 FLUORINE-CONTAINING POLYMER HAVING HETEROAROMATIC RING DAIKIN INDUSTRIES, LTD. (JP) 2012-10-25 US disclosed
US-8252944-B2 Process for preparing heteroaromatic ring compound having N-Rf group DAIKIN INDUSTRIES, LTD. (JP) 2012-08-28 US disclosed
US-8236887-B2 Fluorine-containing polymer having heteroaromatic ring DAIKIN INDUSTRIES, LTD. (JP) 2012-08-07 US disclosed
US-8212053-B2 Process for preparing heteroaromatic ring compound having N-Rf group DAIKIN INDUSTRIES, LTD. (JP) 2012-07-03 US disclosed
US-20120116097-A1 PROCESS FOR PREPARING HETEROAROMATIC RING COMPOUND HAVING N-Rf GROUP DAIKIN INDUSTRIES, LTD. (JP) 2012-05-10 US disclosed
US-20100222598-A1 PROCESS FOR PREPARING HETEROAROMATIC RING COMPOUND HAVING N-Rf GROUP DAIKIN INDUSTRIES, LTD. (JP) 2010-09-02 US disclosed
US-20090105400-A1 Imidazolium side chains for example; for example polymers based on 1-methyl-3-(2H,9H,9H-perfluoro-3,6-dioxa-5-methyl-8-nonenyl)-imidazolium trifluoromethanesulfonate; polymer electrolytes for fuel cell, secondary battery, capacitor, dye-sensitized solar cell and electrochromic device DAIKIN INDUSTRIES, LTD. (JP) 2009-04-23 US disclosed
EP-1983008-A1 FLUORINE-CONTAINING POLYMER CONTAINING HETEROAROMATIC RING Daikin Industries, Ltd. (JP) 2008-10-22 EP disclosed
EP-1975157-A1 METHOD FOR PRODUCTION OF HETEROAROMATIC RING COMPOUND HAVING N-Rf GROUP Daikin Industries, Ltd. (JP) 2008-10-01 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-20100222598-A1 PROCESS FOR PREPARING HETEROAROMATIC RING COMPOUND HAVING N-Rf GROUP CYP2F1, AFF1, AFF2 ALDH1A1 2332/4885KMT2A 980/4885KDM4E 1826/4885
US-20120116097-A1 PROCESS FOR PREPARING HETEROAROMATIC RING COMPOUND HAVING N-Rf GROUP CYP2F1, AFF1, AFF2 ALDH1A1 2332/4885KMT2A 980/4885KDM4E 1826/4885

“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.