SCHEMBL20362091

SCHEMBL20362091

COc1ccc2cc(-c3nc(-c4ccc(Br)cc4)no3)cnc2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 12/20 0.64
▸ MEN1 O00255 3/20 0.64
▸ KMT2A Q03164 3/20 0.64
▸ HPGD P15428 3/20 0.64
▸ NPSR1 Q6W5P4 2/20 0.64
▸ SMN1; SMN2 Q16637 8/20 0.62
▸ TP53 P04637 3/20 0.62
▸ NFKB1 P19838 2/20 0.62
▸ NFKB2 Q00653 2/20 0.62
▸ RELA Q04206 2/20 0.62
▸ NPC1 O15118 11/20 0.54
▸ MAPT P10636 7/20 0.54
▸ PDGFRB P09619 2/20 0.53
▸ PDGFRA P16234 2/20 0.53
▸ NR1H4 Q96RI1 2/20 0.52
▸ S1PR1 P21453 1/20 0.52
▸ TDP1 Q9NUW8 2/20 0.51
▸ HTT P42858 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ HSD17B10 Q99714 2/20 0.50

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
SCHEMBL20374421 0.82 RAB9A (0.51) RAB9AMEN1KMT2AHPGDNPSR1
SCHEMBL20374414 0.82 SNCA (0.50) RAB9AMEN1KMT2AHPGDNPSR1
SCHEMBL3014652 0.76 PDGFRB (0.79) RAB9ANPC1PDGFRBPDGFRA
SCHEMBL17393443 0.76 RAB9A (0.58) RAB9AMEN1KMT2AHPGDNPSR1
SCHEMBL1069738 0.75 HPGDS (0.59) RAB9AMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL12895918 0.75 RAB9A (0.76) RAB9AMEN1KMT2AHPGDNPSR1
SCHEMBL20362087 0.74 PDGFRB (0.54) RAB9AMEN1KMT2AHPGDNPSR1
SCHEMBL21282157 0.74 S1PR1 (0.66) RAB9AMEN1KMT2AHPGDNPSR1
SCHEMBL1249937 0.73 MAPT (0.60) RAB9AMEN1KMT2AHPGDNPSR1
SCHEMBL12692350 0.72 NPC1 (0.86) RAB9AMEN1KMT2AHPGDNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3565807-B1 OXADIAZOLE INHIBITORS OF HIPK2 FOR TREATING KIDNEY FIBROSIS ICAHN SCHOOL MED MOUNT SINAI (US) 2021-09-22 — — EP disclosed
EP-3565807-B1 OXADIAZOLE INHIBITORS OF HIPK2 FOR TREATING KIDNEY FIBROSIS ICAHN SCHOOL MED MOUNT SINAI (US) 2021-09-22 — — EP disclosed
US-10669266-B2 Oxadiazole inhibitors of HIPK2 for treating kidney fibrosis ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2020-06-02 — — US disclosed
US-10669266-B2 Oxadiazole inhibitors of HIPK2 for treating kidney fibrosis ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2020-06-02 — — US disclosed
US-20190352292-A1 OXADIAZOLE INHIBITORS OF HIPK2 FOR TREATING KIDNEY FIBROSIS ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2019-11-21 — — US disclosed
US-20190352292-A1 OXADIAZOLE INHIBITORS OF HIPK2 FOR TREATING KIDNEY FIBROSIS ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2019-11-21 — — US disclosed
EP-3565807-A1 OXADIAZOLE INHIBITORS OF HIPK2 FOR TREATING KIDNEY FIBROSIS Icahn School of Medicine at Mount Sinai (US) 2019-11-13 — — EP disclosed
WO-2018129274-A1 OXADIAZOLE INHIBITORS OF HIPK2 FOR TREATING KIDNEY FIBROSIS ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2018-07-12 — — WO disclosed
WO-2018129274-A1 OXADIAZOLE INHIBITORS OF HIPK2 FOR TREATING KIDNEY FIBROSIS ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2018-07-12 — — 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 (2 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-20190352292-A1 OXADIAZOLE INHIBITORS OF HIPK2 FOR TREATING KIDNEY FIBROSIS HIPK2, HIPK3, HIPK1 RAB9A 3468/4885MEN1 2723/4885KMT2A 1835/4885
US-10669266-B2 Oxadiazole inhibitors of HIPK2 for treating kidney fibrosis HIPK2, HIPK3, HIPK1 RAB9A 3468/4885MEN1 2723/4885KMT2A 1835/4885

“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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