SCHEMBL13573333

SCHEMBL13573333

CCCCOc1c(-c2nnc(Cc3ccc(F)cc3)o2)nn2c1C(=O)N(C)C[C@@H]2c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
APLNR P35414 10/20 0.38
RAB9A P51151 3/20 0.35
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TP53 P04637 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 1/20 0.34
NPC1 O15118 2/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL13572504 0.90 MAPT (0.39) MAPTAPLNRRAB9AHPGDSMN1; SMN2
SCHEMBL4277137 0.90 MAPT (0.39) MAPTAPLNRRAB9AHPGDSMN1; SMN2
SCHEMBL4552948 0.84 MAPT (0.42) MAPTAPLNRRAB9AHPGDSMN1; SMN2
SCHEMBL4277845 0.84 MAPT (0.42) MAPTAPLNRRAB9AHPGDSMN1; SMN2
SCHEMBL13573331 0.82 HSD17B2 (0.33) SMN1; SMN2POLB
SCHEMBL13572505 0.76 ALOX12 (0.38) MAPTAPLNRRAB9AHPGDSMN1; SMN2
SCHEMBL13573330 0.73 RIPK1 (0.39) MAPTHPGDL3MBTL1POLB
SCHEMBL4275512 0.73 SMN1; SMN2 (0.35) SMN1; SMN2L3MBTL1POLBLMNA
SCHEMBL13572503 0.73 SMN1; SMN2 (0.35) SMN1; SMN2L3MBTL1POLBLMNA
SCHEMBL16925413 0.68 KCNA3 (0.44) MAPTAPLNRRAB9AHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090312335-A1 Hiv Integrase Inhibitors MERCK SHARP & DOHME CORP. 2009-12-17 US disclosed
WO-2007050510-A2 HIV INTEGRASE INHIBITORS MERCK & CO., INC. (US) 2007-05-03 WO 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-20090312335-A1 Hiv Integrase Inhibitors RECQL, TYMP, POLR2H MAPT 2808/4885APLNR 4879/4885RAB9A 2531/4885

“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.