SCHEMBL3767646

SCHEMBL3767646

CCOc1ccc2c(c1)nc(C(F)(F)F)n2-c1ccc(NC(=O)c2c(F)c(F)c(F)c(F)c2F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.46
RAB9A P51151 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
GAA P10253 1/20 0.46
TP53 P04637 4/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
HPGD P15428 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 2/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 1/20 0.41
ACSS2 Q9NR19 1/20 0.40
PAX8 Q06710 1/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL2092496 0.90 SMN1; SMN2 (0.43) MAPTRAB9ASMN1; SMN2TP53L3MBTL1
SCHEMBL15000706 0.84 MAP3K7 (0.40) GAATP53HPGDALDH1A1MEN1
SCHEMBL2090228 0.81 RAB9A (0.40) MAPTRAB9ASMN1; SMN2TP53L3MBTL1
SCHEMBL13324404 0.80 RAB9A (0.51) MAPTRAB9AL3MBTL1ALDH1A1KMT2A
SCHEMBL2092551 0.79 MAPT (0.43) MAPTRAB9ASMN1; SMN2GAATP53
SCHEMBL2093470 0.78 NPC1 (0.45) MAPTRAB9ASMN1; SMN2TP53HPGD
SCHEMBL2093003 0.78 CTSD (0.43) MAPTRAB9ASMN1; SMN2GAAALDH1A1
SCHEMBL2095009 0.78 MAPT (0.48) MAPTRAB9AGAAALDH1A1MEN1
SCHEMBL10187893 0.77 ABCG2 (0.42) MAPTRAB9ASMN1; SMN2TP53HPGD
SCHEMBL13324347 0.77 RAB9A (0.47) MAPTRAB9ASMN1; SMN2TP53HPGD

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-8314134-B2 Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2012-11-20 US disclosed
US-20100311787-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2010-12-09 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-20100311787-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCR2, CXCL8, CCR9 MAPT 1416/4885RAB9A 1725/4885SMN1; SMN2 4722/4885

“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.