SCHEMBL324371

SCHEMBL324371

FC(F)(F)c1cccc(-n2nnnc2CCl)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.51
ALDH1A1 P00352 3/20 0.51
NPSR1 Q6W5P4 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 1/20 0.51
TSHR P16473 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.50
LMNA P02545 1/20 0.50
NOTUM Q6P988 4/20 0.48
POLB P06746 2/20 0.44
P2RX7 Q99572 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL324352 0.82 ALDH1A1 (0.64) CYP1A2ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL10371924 0.81 ALDH1A1 (0.54) CYP1A2ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL10238863 0.80 ALDH1A1 (0.57) CYP1A2ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL14605772 0.78 HSD11B1 (0.65) CYP1A2ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL28461383 0.78 CYP1A2 (0.55) CYP1A2ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL11163153 0.78 ALDH1A1 (0.54) CYP1A2ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL16192377 0.77 L3MBTL1 (0.53) CYP1A2ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL15179376 0.77 LMNA (0.47) CYP1A2ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL324270 0.77 ALDH1A1 (0.69) CYP1A2ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL15179489 0.76 MAPT (0.46) CYP1A2ALDH1A1NPSR1SMN1; SMN2MAPT

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
US-9750719-B2 Tetrazole compounds as calcium channel blockers Convergence Pharmaceuticals Limited (GB) 2017-09-05 US disclosed
US-20160015687-A1 TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS Convergence Pharmaceuticals Limited (GB) 2016-01-21 US disclosed
US-9115132-B2 Tetrazole compounds as calcium channel blockers Convergence Pharmaceuticals Limited (GB) 2015-08-25 US disclosed
EP-2590953-B1 TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS CONVERGENCE PHARMACEUTICALS (GB) 2014-10-29 EP disclosed
US-20130210796-A1 TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS Convergence Pharmaceuticals Limited 2013-08-15 US disclosed
EP-2590953-A1 TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS Convergence Pharmaceuticals Limited (GB) 2013-05-15 EP disclosed
WO-2012004604-A1 TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS Convergence Pharmaceuticals Limited (GB) 2012-01-12 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 (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-20130210796-A1 TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS CACNA1G, CACNA1I, CACNB2 CYP1A2 654/4885ALDH1A1 2584/4885NPSR1 1585/4885
US-20160015687-A1 TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS CACNA1G, CACNA1I, CACNB2 CYP1A2 654/4885ALDH1A1 2584/4885NPSR1 1585/4885

“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.