SCHEMBL15524418

SCHEMBL15524418

COC(=O)Cc1ccccc1C#Cc1nc(Cl)ncc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.47
PIN1 Q13526 1/20 0.35
ALDH1A1 P00352 4/20 0.34
MAPT P10636 4/20 0.34
TDP1 Q9NUW8 3/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
KDM4E B2RXH2 3/20 0.33
HSD17B10 Q99714 2/20 0.33
GAA P10253 1/20 0.33
TLR7 Q9NYK1 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL15524319 0.89 PTGDR2 (0.37) FFAR1PIN1ALDH1A1MAPTTDP1
SCHEMBL15524605 0.87 FFAR1 (0.48) FFAR1PIN1MAPTTDP1SMN1; SMN2
SCHEMBL15523754 0.79 FFAR1 (0.53) FFAR1ALDH1A1HPGDSMN1; SMN2NPC1
SCHEMBL15524824 0.77 FLT4 (0.50)
SCHEMBL15524296 0.76 FFAR1 (0.36) FFAR1PIN1PTGDR2
SCHEMBL15502417 0.72 FFAR1 (0.45) FFAR1PIN1
SCHEMBL3623135 0.72 KDM4E (0.43) FFAR1ALDH1A1MAPTTDP1HPGD
SCHEMBL15567991 0.71 SMN1; SMN2 (0.35) FFAR1ALDH1A1MAPTTDP1HPGD
SCHEMBL21373807 0.71 ALDH1A1 (0.40) FFAR1ALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL12478570 0.71 RXFP1 (0.41) ALDH1A1MAPTTDP1HPGDTP53

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-9266864-B2 VEGFR3 inhibitors CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2016-02-23 US disclosed
US-9266864-B2 VEGFR3 inhibitors CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2016-02-23 US disclosed
US-9266864-B2 VEGFR3 inhibitors CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2016-02-23 US disclosed
US-20150225377-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2015-08-13 US disclosed
US-20150225377-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2015-08-13 US disclosed
US-20150225377-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2015-08-13 US disclosed
EP-2885292-A1 VEGFR3 INHIBITORS Cancer Therapeutics Crc Pty Limited (AU) 2015-06-24 EP disclosed
US-20140080798-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2014-03-20 US disclosed
US-20140080798-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2014-03-20 US disclosed
US-20140080798-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2014-03-20 US disclosed
WO-2014026242-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2014-02-20 WO disclosed
US-20090068168-A1 SUBSTITUTED AMINO ALCOHOLS AUSPEX PHARMACEUTICALS, INC. (US) 2009-03-12 US 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 (3 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-20090068168-A1 SUBSTITUTED AMINO ALCOHOLS GOT1, AADAT, ADH1A FFAR1 1573/4885PIN1 4797/4885ALDH1A1 124/4885
US-20150225377-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR FFAR1 2245/4885PIN1 3375/4885ALDH1A1 1985/4885
US-20140080798-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR FFAR1 1375/4885PIN1 2479/4885ALDH1A1 2096/4885

“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.