SCHEMBL4839059

SCHEMBL4839059

Fc1c2cc3ccccc3cc2c(F)c2cc3ccccc3cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 6/20 0.50
CYP1A2 P05177 3/20 0.50
ALDH1A1 P00352 4/20 0.46
HSD17B10 Q99714 3/20 0.46
HIF1A Q16665 1/20 0.46
CYP1B1 Q16678 1/20 0.46
NQO1 P15559 1/20 0.44
ALOX12 P18054 1/20 0.41
HPRT1 P00492 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
TSHR P16473 1/20 0.40
TRPM4 Q8TD43 1/20 0.40
NQO2 P16083 2/20 0.39
CYP3A4 P08684 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL6837157 0.91 CYP2A6 (0.48) CYP2A6CYP1A2ALDH1A1HSD17B10HIF1A
SCHEMBL2790386 0.86 CYP2A6 (0.44) CYP2A6CYP1A2ALDH1A1HSD17B10HIF1A
SCHEMBL8916693 0.86 CYP2A6 (0.44) CYP2A6CYP1A2ALDH1A1HSD17B10HIF1A
SCHEMBL18606189 0.84 CYP2A6 (0.42) CYP2A6CYP1A2ALDH1A1HSD17B10HIF1A
SCHEMBL12402880 0.82 CYP2A6 (0.46) CYP2A6CYP1A2ALDH1A1HSD17B10HIF1A
SCHEMBL10845998 0.82 ALDH1A1 (0.48) CYP2A6CYP1A2ALDH1A1HSD17B10HIF1A
SCHEMBL18606148 0.80 CYP2A6 (0.39) CYP2A6CYP1A2ALDH1A1HSD17B10HIF1A
SCHEMBL29423353 0.79 ALDH1A1 (0.56) CYP2A6CYP1A2ALDH1A1HSD17B10HIF1A
SCHEMBL28463321 0.79 ALDH1A1 (0.56) CYP2A6CYP1A2ALDH1A1HSD17B10HIF1A
SCHEMBL190942 0.79 ALDH1A1 (0.56) CYP2A6CYP1A2ALDH1A1HSD17B10HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed
US-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed
US-7439407-B2 Fluorinated pentacene derivative and method of producing same KANTO DENTA KOGYO CO., LTD. (JP) 2008-10-21 US disclosed
US-7439407-B2 Fluorinated pentacene derivative and method of producing same KANTO DENTA KOGYO CO., LTD. (JP) 2008-10-21 US disclosed
US-7439407-B2 Fluorinated pentacene derivative and method of producing same KANTO DENTA KOGYO CO., LTD. (JP) 2008-10-21 US disclosed
US-7439407-B2 Fluorinated pentacene derivative and method of producing same KANTO DENTA KOGYO CO., LTD. (JP) 2008-10-21 US disclosed
US-20070083067-A1 Fluorinated pentacene derivative and method of producing same KANTO DENKA KOGYO CO. LTD. (JP) 2007-04-12 US disclosed
US-20070083067-A1 Fluorinated pentacene derivative and method of producing same KANTO DENKA KOGYO CO. LTD. (JP) 2007-04-12 US disclosed
US-20070083067-A1 Fluorinated pentacene derivative and method of producing same KANTO DENKA KOGYO CO. LTD. (JP) 2007-04-12 US disclosed
US-20070083067-A1 Fluorinated pentacene derivative and method of producing same KANTO DENKA KOGYO CO. LTD. (JP) 2007-04-12 US disclosed
WO-2005042445-A3 FLUORINATED PENTACENE DERIVATIVES AND PROCESSES FOR PRODUCING THESE KANTO DENKA KOGYO KK (JP) 2005-07-14 WO disclosed
WO-2005042445-A2 FLUORINATED PENTACENE DERIVATIVES AND PROCESSES FOR PRODUCING THESE KANTO DENKA KOGYO KK (JP) 2005-05-12 WO 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-20070083067-A1 Fluorinated pentacene derivative and method of producing same FAR1, FAM162A, FFAR4 CYP2A6 2678/4885CYP1A2 2877/4885ALDH1A1 1732/4885

“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.