SCHEMBL5208057

SCHEMBL5208057

COC(=O)c1ccc(NC(=O)CCc2oc(-n3cnc4ccccc43)nc2-c2ccc(Cl)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.46
DRD2 P14416 5/20 0.44
TBXA2R P21731 5/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 6/20 0.43
LMNA P02545 1/20 0.43
GLA P06280 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
HTT P42858 1/20 0.42
POLB P06746 2/20 0.42
TP53 P04637 2/20 0.41
THRB P10828 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
KDR P35968 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KDM4E B2RXH2 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
SCHEMBL5211421 0.93 TNKS (0.42) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL5212587 0.91 THRB (0.50) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5215192 0.90 PIN1 (0.43) MAPTPOLB
SCHEMBL5207954 0.89 RAB9A (0.42) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL5208205 0.89 TP53 (0.42) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL5211745 0.88 MAPT (0.41) MAPTRAB9ASMN1; SMN2NPC1POLB
SCHEMBL5212224 0.88 MAPT (0.43) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL5211475 0.88 MAPT (0.41) MEN1KMT2AMAPTLMNARAB9A
SCHEMBL5212278 0.88 TP53 (0.52) MAPTLMNASMN1; SMN2HTTTP53
SCHEMBL5213361 0.87 THRB (0.38) MAPTSMN1; SMN2POLBTP53THRB

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-7183276-B2 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-27 US disclosed
US-20050090534-A1 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-04-28 US disclosed
EP-1486490-A1 AZOLE COMPOUNDS Takeda Chemical Industries, Ltd. (JP) 2004-12-15 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-20050090534-A1 Azole compounds AHR, NR0B2, NR2C2 FGFR1 1046/4885DRD2 379/4885TBXA2R 1138/4885

“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.