SCHEMBL5523975

SCHEMBL5523975

COc1ccc(CNC(=O)C2CCCCC2)cc1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.75
SMN1; SMN2 Q16637 3/20 0.75
NPC1 O15118 1/20 0.67
RAB9A P51151 1/20 0.67
HDAC6 Q9UBN7 1/20 0.62
TDP1 Q9NUW8 1/20 0.61
GAA P10253 1/20 0.60
USP2 O75604 1/20 0.59
HPGD P15428 1/20 0.59
POLB P06746 1/20 0.59
MAPT P10636 1/20 0.59
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
TSHR P16473 1/20 0.58

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
SCHEMBL15453396 0.92 ALDH1A1 (0.81) ALDH1A1SMN1; SMN2NPC1RAB9ATDP1
SCHEMBL26097960 0.92 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2NPC1RAB9AHDAC6
SCHEMBL26102262 0.91 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2NPC1RAB9ATDP1
SCHEMBL23747460 0.90 SMN1; SMN2 (0.65) ALDH1A1SMN1; SMN2NPC1RAB9AHDAC6
SCHEMBL26100647 0.88 SMN1; SMN2 (0.67) ALDH1A1SMN1; SMN2NPC1RAB9AHDAC6
SCHEMBL26102668 0.88 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2NPC1RAB9ATDP1
SCHEMBL17182848 0.87 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2NPC1RAB9ATDP1
SCHEMBL17182851 0.87 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2NPC1RAB9ATDP1
SCHEMBL17182903 0.87 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2NPC1RAB9ATDP1
SCHEMBL13745650 0.86 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2NPC1RAB9ATDP1

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-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof ARENA PHARMACEUTICALS, INC. 2007-01-11 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-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof MCHR1, GPR119, MCHR2 ALDH1A1 2069/4885SMN1; SMN2 1509/4885NPC1 412/4885

“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.