SCHEMBL17038141

SCHEMBL17038141

CCc1ccc2nc(C=O)sc2c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
NPC1 O15118 5/20 0.59
TP53 P04637 4/20 0.48
MAPT P10636 6/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
KCNH2 Q12809 1/20 0.44
LMNA P02545 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
KAT8 Q9H7Z6 1/20 0.40

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
SCHEMBL24975786 0.84 RAB9A (0.44) RAB9ASMN1; SMN2NPC1MAPTKDM4E
SCHEMBL11173803 0.81 MAPT (0.56) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL15356380 0.81 SMN1; SMN2 (0.56) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL17038139 0.81 RAB9A (0.56) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL31428993 0.80 NPC1 (0.44) RAB9ASMN1; SMN2NPC1MAPTKMT2A
SCHEMBL17038138 0.76 SMN1; SMN2 (0.58) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL7601340 0.76 RAB9A (0.67) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL10271447 0.76 SMN1; SMN2 (0.67) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL2756575 0.76 RAB9A (0.67) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL16155802 0.75 ATP4A (0.55) RAB9ASMN1; SMN2NPC1TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150239878-A1 Novel Compounds for Imaging Tau Proteins That Accumulate In Brain NATIONAL INSTITUTES FOR QUANTUM AND RADIOLOGICAL SCIENCE AND TECHNOLOGY (JP) 2015-08-27 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 (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-20150239878-A1 Novel Compounds for Imaging Tau Proteins That Accumulate In Brain MAPT, FABP7, HTT RAB9A 1040/4885SMN1; SMN2 2701/4885NPC1 1994/4885

“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.