SCHEMBL2755844

SCHEMBL2755844

Cc1cc(NC(N)=O)ccc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.55
NPC1 O15118 2/20 0.50
KIF11 P52732 1/20 0.50
PEPD P12955 1/20 0.47
BLM P54132 1/20 0.46
POLB P06746 1/20 0.46
LCK P06239 2/20 0.45
FYN P06241 2/20 0.45
CSF1R P07333 2/20 0.45
LYN P07948 2/20 0.45
KIT P10721 2/20 0.45
SRC P12931 2/20 0.45
FLT1 P17948 2/20 0.45
FLT4 P35916 2/20 0.45
KDR P35968 2/20 0.45
FLT3 P36888 2/20 0.45
BLK P51451 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL2755843 0.85 KMT2A (0.59) ALDH1A1NPC1KIF11POLBKMT2A
SCHEMBL405478 0.83 ALDH1A1 (0.57) ALDH1A1NPC1POLBKMT2AMEN1
SCHEMBL6918008 0.82 POLB (0.66) ALDH1A1NPC1KIF11PEPDPOLB
SCHEMBL4795850 0.82 ALDH1A1 (0.61) ALDH1A1NPC1PEPDRAB9ASMN1; SMN2
SCHEMBL12157836 0.81 CYP1A2 (0.53) ALDH1A1KIF11KMT2AMEN1HTT
SCHEMBL20560673 0.81 NPC1 (0.49) ALDH1A1NPC1BLMPOLBLCK
SCHEMBL13623357 0.81 POLB (0.54) ALDH1A1POLBFLT1FLT4KDR
SCHEMBL15172131 0.80 ALDH1A1 (0.55) ALDH1A1NPC1BLMPOLBLCK
SCHEMBL29824382 0.80 ALDH1A1 (0.55) ALDH1A1NPC1BLMPOLBLCK
SCHEMBL18117790 0.79 ALDH1A1 (0.57) ALDH1A1NPC1KIF11PEPDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0652871-A1 BENZODIAZEPINE DERIVATIVES MERCK SHARP & DOHME LTD. (GB) 1995-05-17 EP claimed
US-8383813-B2 Fused pyrrolocarbazoles CEPHALON, INC. (US) 2013-02-26 US disclosed
US-8383813-B2 Fused pyrrolocarbazoles CEPHALON, INC. (US) 2013-02-26 US disclosed
US-20120004253-A1 Novel Fused Pyrrolocarbazoles CEPHALON, INC. (US) 2012-01-05 US disclosed
US-20120004253-A1 Novel Fused Pyrrolocarbazoles CEPHALON, INC. (US) 2012-01-05 US disclosed
US-8044064-B2 Fused pyrrolocarbazoles CEPHALON, INC. (US) 2011-10-25 US disclosed
US-8044064-B2 Fused pyrrolocarbazoles CEPHALON, INC. (US) 2011-10-25 US disclosed
US-20100152196-A1 Novel Fused Pyrrolocarbazoles CEPHALON, INC. (US) 2010-06-17 US disclosed
US-20100152196-A1 Novel Fused Pyrrolocarbazoles CEPHALON, INC. (US) 2010-06-17 US disclosed
US-7671064-B2 Fused pyrrolocarbazoles CEPHALON, INC. (US) 2010-03-02 US disclosed
US-7671064-B2 Fused pyrrolocarbazoles CEPHALON, INC. (US) 2010-03-02 US disclosed
US-7169802-B2 Fused pyrrolocarbazoles CEPHALON, INC. (US) 2007-01-30 US disclosed
US-7169802-B2 Fused pyrrolocarbazoles CEPHALON, INC. (US) 2007-01-30 US disclosed
WO-2005063763-A1 NOVEL FUSED PYRROLOCARBAZOLES CEPHALON, INC. (US) 2005-07-14 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-20100152196-A1 Novel Fused Pyrrolocarbazoles PC, PYCR1, CYP11B2 ALDH1A1 467/4885NPC1 132/4885KIF11 1912/4885
US-20120004253-A1 Novel Fused Pyrrolocarbazoles PC, PYCR1, CYP11B2 ALDH1A1 467/4885NPC1 132/4885KIF11 1912/4885

“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.