SCHEMBL4532323

SCHEMBL4532323

CC1(C)NCc2c1nn(C(=O)O)c2NC(=O)c1ccccc1F

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TP53 P04637 1/20 0.40
GLA P06280 1/20 0.40
HSD17B10 Q99714 1/20 0.40
POLB P06746 2/20 0.40
MEN1 O00255 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
PAK4 O96013 1/20 0.39
HTT P42858 1/20 0.39
GRM5 P41594 1/20 0.39

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
SCHEMBL1204639 0.87 ALDH1A1 (0.47) KMT2ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL4521702 0.82 CCNA2 (0.41) KMT2ARAB9ASMN1; SMN2ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL17956348 0.81 CCNA2 (0.41) KMT2ARAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL1205681 0.73 ALDH1A1 (0.43) KMT2ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL19305447 0.71
SCHEMBL4775829 0.71 KDM4E (0.42) KMT2ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL4291472 0.70 FLT3 (0.40) NPC1RAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL12879128 0.70 ALDH1A1 (0.44) KMT2ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL1206401 0.69 MAPT (0.43) KMT2ARAB9ASMN1; SMN2ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL4291464 0.69 FLT3 (0.40) NPC1RAB9ASMN1; SMN2ALDH1A1HSD17B10

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-20090318440-A1 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS PFIZER INC. 2009-12-24 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-20090318440-A1 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS PAK4, PAK5, PAK3 KMT2A 2472/4885NPC1 4116/4885RAB9A 1222/4885

“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.