SCHEMBL11987656

SCHEMBL11987656

Bc1cc(-c2nnc(-c3cnc4ccccc4c3)o2)cc(-c2nnc(-c3cnc4ccccc4c3)o2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 3/20 0.46
▸ PDGFRA P16234 3/20 0.46
▸ NPC1 O15118 5/20 0.44
▸ RAB9A P51151 5/20 0.44
▸ CYP2A6 P11509 1/20 0.44
▸ ATR Q13535 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ CYP1A2 P05177 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ BIRC5 O15392 1/20 0.43
▸ PIK3CD O00329 1/20 0.42
▸ PIK3CA P42336 1/20 0.42
▸ UTRN P46939 2/20 0.41
▸ MAPT P10636 2/20 0.40
▸ NISCH Q9Y2I1 1/20 0.40

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
SCHEMBL11987321 0.89 NPC1 (0.54) PDGFRBPDGFRANPC1RAB9ACYP2A6
SCHEMBL11987330 0.87 PDGFRB (0.51) PDGFRBPDGFRANPC1RAB9ACYP2A6
SCHEMBL4169352 0.86 BIRC5 (0.54) PDGFRBPDGFRANPC1RAB9ACYP2A6
SCHEMBL11987335 0.85 CYP1A2 (0.51) PDGFRBPDGFRANPC1RAB9ACYP2A6
SCHEMBL11987345 0.85 NPC1 (0.51) PDGFRBPDGFRANPC1RAB9ACYP2A6
SCHEMBL11987344 0.83 CYP1A2 (0.58) PDGFRBPDGFRANPC1RAB9ACYP2A6
SCHEMBL11987341 0.81 BIRC5 (0.48) PDGFRBPDGFRANPC1RAB9ACYP2A6
SCHEMBL11987325 0.80 PDGFRB (0.44) PDGFRBPDGFRANPC1RAB9ACYP2A6
SCHEMBL11987327 0.79 PDGFRB (0.47) PDGFRBPDGFRANPC1RAB9ACYP2A6
SCHEMBL1423059 0.78 CYP2A6 (0.70) PDGFRBPDGFRANPC1RAB9ACYP2A6

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-8247087-B2 Compound having oxadiazole ring structure bonded with aromatic heterocyclic ring and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2012-08-21 — — US disclosed
US-20090230849-A1 COMPOUND HAVING OXADIAZOLE RING STRUCTURE BONDED WITH AROMATIC HETEROCYCLIC RING AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2009-09-17 — — 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-20090230849-A1 COMPOUND HAVING OXADIAZOLE RING STRUCTURE BONDED WITH AROMATIC HETEROCYCLIC RING AND ORGANIC ELECTROLUMINESCENT DEVICE OXA1L, ORC3, OCIAD1 PDGFRB 3954/4885PDGFRA 3737/4885NPC1 3174/4885

“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.

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