SCHEMBL4140780

SCHEMBL4140780

Clc1ccc(-c2cc3c4ccccc4ccc3n2-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
KCNH2 Q12809 2/20 0.41
AOC3 Q16853 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
MDM2 Q00987 2/20 0.38
HTT P42858 1/20 0.38
CYP1A1 P04798 3/20 0.37
CYP1A2 P05177 3/20 0.37
CYP1B1 Q16678 3/20 0.37

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
SCHEMBL4148824 0.86 EGFR (0.46) ALDH1A1MAPTEGFRERBB2L3MBTL1
SCHEMBL2991478 0.86 KDM4E (0.46) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL4155464 0.82 MGAM (0.42) L3MBTL1KDM4EATMMAT2A
SCHEMBL12091770 0.82 PTGER4 (0.45) ALDH1A1MAPTHPGDNPSR1L3MBTL1
SCHEMBL2998653 0.82 TDP1 (0.44) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL2999265 0.81 PLA2G10 (0.53) MAPTMDM2CYP1A2
SCHEMBL4148027 0.81 DHODH (0.41) ALDH1A1MAPTHPGDKCNH2AOC3
SCHEMBL23024879 0.80 AOC3 (0.52) ALDH1A1MAPTHPGDNPSR1RXFP1
SCHEMBL12249842 0.80 EGFR (0.39) ALDH1A1MAPTHPGDNPSR1RXFP1
SCHEMBL12249846 0.78 PTGES (0.42) ALDH1A1MAPTHPGDNPSR1RXFP1

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-9216966-B2 Compounds for Alzheimer's disease Manfredi, John (US) 2015-12-22 US disclosed
US-9034871-B2 Compounds for Alzheimer's disease Manfredi, John (US) 2015-05-19 US disclosed
EP-1809601-B1 COMPOUNDS FOR ALZHEIMER'S DISEASE MANFREDI JOHN (US) 2014-09-10 EP disclosed
US-20130261118-A1 COMPOUNDS FOR ALZHEIMER'S DISEASE MANFREDI JOHN (US) 2013-10-03 US disclosed
US-20120225873-A1 COMPOUNDS FOR ALZHEIMER'S DISEASE MYREXIS, INC. (US) 2012-09-06 US disclosed
US-20090099179-A1 COMPOUNDS FOR DISEASES AND DISORDERS MYRIAD GENETICS, INCORPORATED (US) 2009-04-16 US disclosed
US-20080249135-A1 N-phenylindoles; oral dosage forms; side effect reduction MYRIAD GENETICS, INCORPORATED (US) 2008-10-09 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 (4 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-20130261118-A1 COMPOUNDS FOR ALZHEIMER'S DISEASE SLC18A2, SLC18A3, NLN ALDH1A1 2169/4885MAPT 10/4885HPGD 1761/4885
US-20090099179-A1 COMPOUNDS FOR DISEASES AND DISORDERS CLN6, NLN, CLTC ALDH1A1 1938/4885MAPT 657/4885HPGD 3787/4885
US-20080249135-A1 N-phenylindoles; oral dosage forms; side effect reduction NCL, PSEN2, CCNO ALDH1A1 2795/4885MAPT 46/4885HPGD 1568/4885
US-20120225873-A1 COMPOUNDS FOR ALZHEIMER'S DISEASE PSEN2, CHAT, PSEN1 ALDH1A1 1321/4885MAPT 24/4885HPGD 2955/4885

“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.