SCHEMBL9921335

SCHEMBL9921335

Fc1cnc2ncnc(NCCc3ccc(Cl)cc3)c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 8/20 0.60
▸ TTBK1 Q5TCY1 1/20 0.55
▸ TTBK2 Q6IQ55 1/20 0.55
▸ LMNA P02545 4/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ NR2F2 P24468 1/20 0.52
▸ CNR1 P21554 3/20 0.47
▸ CNR2 P34972 3/20 0.47
▸ SLC29A1 Q99808 1/20 0.44
▸ PIK3CD O00329 1/20 0.44
▸ PIK3R1 P27986 1/20 0.44
▸ NTRK1 P04629 1/20 0.43
▸ MAPT P10636 2/20 0.43
▸ TP53 P04637 2/20 0.43
▸ EGFR P00533 1/20 0.42

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
SCHEMBL9921330 0.88 HTT (0.47) HTTTTBK1TTBK2LMNAMEN1
SCHEMBL9921325 0.88 HTT (0.55) HTTTTBK1TTBK2LMNAMEN1
SCHEMBL9921323 0.88 HTT (0.52) HTTTTBK1TTBK2LMNAMEN1
SCHEMBL9921422 0.85 HTT (0.50) HTTTTBK1TTBK2LMNATSHR
SCHEMBL13171084 0.85 HTT (0.45) HTTTTBK1TTBK2LMNAMEN1
SCHEMBL9921415 0.84 MAPT (0.59) HTTLMNAMEN1TSHRKMT2A
SCHEMBL9921326 0.84 HTT (0.44) HTTTTBK1TTBK2LMNAMEN1
SCHEMBL9921423 0.82 HTT (0.47) HTTLMNAMEN1TSHRKMT2A
SCHEMBL9921352 0.81 HTT (0.81) HTTTTBK1TTBK2LMNANR2F2
SCHEMBL13171100 0.80 HTT (0.56) HTTTTBK1TTBK2LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012079079-A1 PRODUCTION OF INDUCED PLURIPOTENT STEM CELLS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-06-14 — — WO disclosed
WO-2011011522-A2 POTENT SMALL MOLECULE INHIBITORS OF AUTOPHAGY, AND METHODS OF USE THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-01-27 — — WO disclosed
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