SCHEMBL7216759

SCHEMBL7216759

[CH2]c1nc2cccc(F)c2s1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 1/20 0.36
RAB9A P51151 6/20 0.36
NPC1 O15118 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
ALDH1A1 P00352 4/20 0.36
GAA P10253 3/20 0.36
KDM4E B2RXH2 3/20 0.36
LMNA P02545 3/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 3/20 0.36
HPGD P15428 2/20 0.36
MAPK1 P28482 1/20 0.36
AKR1A1 P14550 1/20 0.35
AKR1B1 P15121 1/20 0.35
PRNP P04156 1/20 0.34
NAAA Q02083 1/20 0.33
PDE10A Q9Y233 2/20 0.32
PARP1 P09874 2/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL31389941 0.78 PSMB8 (0.37) PSMB8RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL4242805 0.76 PSMB8 (0.43) PSMB8RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL2749596 0.76 PSMB8 (0.36) PSMB8RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL7216764 0.76 RAB9A (0.42) PSMB8RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL2747888 0.76 SMN1; SMN2 (0.52) PSMB8RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL30626911 0.76 RAB9A (0.42) PSMB8RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL2748327 0.76 PSMB8 (0.36) PSMB8RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL7223466 0.76 AKR1B1 (0.43) PSMB8RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL12340972 0.76 CASR (0.38) PSMB8RAB9ANPC1SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL30520684 0.74 SMN1; SMN2 (0.50) PSMB8RAB9ANPC1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6576765-B2 Process for preparing amic acid esters IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2003-06-10 US disclosed
US-20030032667-A1 PROCESS FOR PREPARING AMIC ACID ESTERS IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2003-02-13 US disclosed
EP-1182199-A1 PROCESS FOR PREPARING AMIC ACID ESTERS IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) 2002-02-27 EP 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-20030032667-A1 PROCESS FOR PREPARING AMIC ACID ESTERS MCCC2, EMC1, GANC PSMB8 2917/4885RAB9A 774/4885NPC1 2798/4885

“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.