SCHEMBL174141

SCHEMBL174141

Cc1ccc(Nc2ccc(N)cc2Cl)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.68
TDP1 Q9NUW8 3/20 0.68
ALDH1A1 P00352 2/20 0.68
ALOX15 P16050 2/20 0.68
HTT P42858 1/20 0.68
MAPT P10636 5/20 0.58
KDM4E B2RXH2 3/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
POLB P06746 1/20 0.58
RECQL P46063 1/20 0.58
CASP6 P55212 1/20 0.58
ELAVL1 Q15717 1/20 0.58
CYP3A4 P08684 2/20 0.48
NPC1 O15118 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GFER P55789 1/20 0.47
RAPGEF4 Q8WZA2 2/20 0.44
TSHR P16473 1/20 0.43

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
SCHEMBL14864247 0.86 GAA (0.48) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL18590733 0.85 HPGD (0.48) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL10813238 0.83 GAA (0.61) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL15968528 0.81 GAA (1.00) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL11009117 0.80 GAA (0.46) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL21904810 0.80 MAPT (0.56) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL11447609 0.79 GAA (0.65) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL15522452 0.77 ALDH1A1 (0.62) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL11508894 0.77 ALDH1A1 (0.57) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL10914919 0.77 AKR1C3 (0.56) GAATDP1ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611797-B1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI SCIENCE CO LTD (KR) 2016-12-28 EP claimed
US-8835458-B2 Quinoline or quinazoline derivatives with apoptosis inducing activity on cells HANMI SCIENCE CO., LTD (KR) 2014-09-16 US claimed
US-20130165386-A1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI SCIENCE CO., LTD (KR) 2013-06-27 US claimed
EP-2611797-B1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI SCIENCE CO LTD (KR) 2016-12-28 EP disclosed
US-8835458-B2 Quinoline or quinazoline derivatives with apoptosis inducing activity on cells HANMI SCIENCE CO., LTD (KR) 2014-09-16 US disclosed
EP-2611797-A2 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS Hanmi Science Co., Ltd. (KR) 2013-07-10 EP disclosed
US-20130165386-A1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI SCIENCE CO., LTD (KR) 2013-06-27 US disclosed
WO-2012030160-A2 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI HOLDINGS CO., LTD. (KR) 2012-03-08 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-20130165386-A1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS CASP7, API5, BAX GAA 2962/4885TDP1 1090/4885ALDH1A1 4307/4885

“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.