SCHEMBL4128644

SCHEMBL4128644

Cc1cccc(-c2cc(O)c3cccc(N4CCOCC4)c3n2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
KDM4E B2RXH2 3/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 2/20 0.45
ALDH1A1 P00352 2/20 0.45
RAB9A P51151 2/20 0.45
HSD17B10 Q99714 2/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PIK3CA P42336 6/20 0.44
MTOR P42345 1/20 0.44
PLAUR Q03405 3/20 0.43
LMNA P02545 3/20 0.43
MEN1 O00255 1/20 0.43
STK4 Q13043 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
SCHEMBL4113633 0.80 ACHE (0.46) MAPTKDM4EKMT2ANPC1ALDH1A1
SCHEMBL18294643 0.79 AHR (0.54) MAPTKDM4EKMT2ANPC1ALDH1A1
SCHEMBL14271149 0.70 NPSR1 (0.78) MAPTKMT2AALDH1A1HSD17B10HPGD
SCHEMBL6642179 0.69 NCF1 (0.63) MAPTKDM4EKMT2AALDH1A1HSD17B10
SCHEMBL18674614 0.69 AR (0.71) MAPTKDM4EKMT2ANPC1ALDH1A1
SCHEMBL18294610 0.68 ACP1 (0.44) MAPTKDM4EKMT2ANPC1ALDH1A1
SCHEMBL27013950 0.67 HPGD (0.53) MAPTKDM4EKMT2ANPC1ALDH1A1
SCHEMBL14271152 0.67 PIK3CA (0.64) MAPTHSD17B10TSHRPIK3CAMTOR
SCHEMBL23755181 0.67 PIK3CA (0.47) MAPTKDM4EKMT2ANPC1ALDH1A1
SCHEMBL30308223 0.67 PIK3CA (0.47) MAPTKDM4EKMT2ANPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318730-B2 Fused hetrocyclic compounds SYNTA PHARMACEUTICALS CORPORATION (US) 2012-11-27 US disclosed
US-8318730-B2 Fused hetrocyclic compounds SYNTA PHARMACEUTICALS CORPORATION (US) 2012-11-27 US disclosed
US-8318730-B2 Fused hetrocyclic compounds SYNTA PHARMACEUTICALS CORPORATION (US) 2012-11-27 US disclosed
US-7615552-B2 Fused heterocyclic compounds SYNTA PHARMACEUTICALS CORP. (US) 2009-11-10 US disclosed
US-7615552-B2 Fused heterocyclic compounds SYNTA PHARMACEUTICALS CORP. (US) 2009-11-10 US disclosed
US-7615552-B2 Fused heterocyclic compounds SYNTA PHARMACEUTICALS CORP. (US) 2009-11-10 US disclosed
US-20090253694-A1 Fused hetrocyclic compounds SYNTA PHARMACEUTICALS CORP. (US) 2009-10-08 US disclosed
US-20090253694-A1 Fused hetrocyclic compounds SYNTA PHARMACEUTICALS CORP. (US) 2009-10-08 US disclosed
US-20090253694-A1 Fused hetrocyclic compounds SYNTA PHARMACEUTICALS CORP. (US) 2009-10-08 US disclosed
US-20050250770-A1 Fused heterocyclic compounds LSI FINANCING LLC, AS ADMINISTRATIVE AGENT 2005-11-10 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 (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-20050250770-A1 Fused heterocyclic compounds IL2, IL4, IL15 MAPT 1771/4885KDM4E 3523/4885KMT2A 2143/4885
US-20090253694-A1 Fused hetrocyclic compounds IL2, IL15, IL4 MAPT 2861/4885KDM4E 3697/4885KMT2A 2644/4885

“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.