SCHEMBL19002401

SCHEMBL19002401

CCc1nn(-c2ccccc2)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.51
KMT2A Q03164 6/20 0.49
MEN1 O00255 4/20 0.49
NPC1 O15118 4/20 0.49
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 3/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 1/20 0.46
PDE10A Q9Y233 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 1/20 0.43
ADORA3 P0DMS8 2/20 0.42
ADORA1 P30542 2/20 0.42
ADORA2A P29274 1/20 0.42
MAPT P10636 2/20 0.42
CTSA P10619 1/20 0.41
THRB P10828 1/20 0.41

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
SCHEMBL27852360 0.85 RAB9A (0.50) RAB9AKMT2AMEN1NPC1ALDH1A1
SCHEMBL12386626 0.84 RAB9A (0.44) RAB9AKMT2ANPC1ALDH1A1KDM4E
SCHEMBL27852206 0.82 ADORA3 (0.44) KMT2AMEN1ALDH1A1HPGDADORA3
SCHEMBL2563427 0.81 KMT2A (0.48) RAB9AKMT2AMEN1NPC1ALDH1A1
SCHEMBL27946270 0.78 P2RX7 (0.37)
SCHEMBL12871812 0.77 RAB9A (0.44) RAB9AKMT2AMEN1NPC1ALDH1A1
SCHEMBL2754805 0.76 ADORA1 (0.50) RAB9AKMT2AMEN1NPC1ALDH1A1
SCHEMBL7012292 0.76 RAB9A (0.54) RAB9AKMT2AMEN1NPC1ALDH1A1
SCHEMBL12265096 0.74 MAPT (0.64) RAB9AKMT2AMEN1NPC1ALDH1A1
SCHEMBL12338162 0.73 RAB9A (0.41) RAB9AKMT2AMEN1NPC1ALDH1A1

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-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC 2017-06-22 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-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE MAPK6, MAP3K6, MAPK4 RAB9A 2641/4885KMT2A 3544/4885MEN1 4080/4885

“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.