SCHEMBL26606450

SCHEMBL26606450

Cc1ccc(Oc2cccc(C(=O)Nc3nc4ccccc4[nH]3)c2)nn1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 13/20 0.69
▸ NPC1 O15118 12/20 0.69
▸ SMN1; SMN2 Q16637 7/20 0.69
▸ PKM P14618 4/20 0.69
▸ MEN1 O00255 7/20 0.59
▸ KMT2A Q03164 7/20 0.59
▸ MAPT P10636 3/20 0.59
▸ LMNA P02545 2/20 0.59
▸ IRAK4 Q9NWZ3 2/20 0.58
▸ MAOB P27338 1/20 0.56
▸ ADORA2A P29274 1/20 0.56
▸ ALDH1A1 P00352 2/20 0.55
▸ KLF5 Q13887 2/20 0.55
▸ HPGD P15428 1/20 0.55
▸ OPRK1 P41145 1/20 0.55
▸ KDM4E B2RXH2 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ TP53 P04637 1/20 0.54
▸ SCD O00767 1/20 0.52
▸ USP2 O75604 1/20 0.52

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
SCHEMBL26606554 0.89 RAB9A (0.67) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL22193346 0.82 RAB9A (1.00) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL11703862 0.79 NPC1 (0.83) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL8558926 0.78 RAB9A (0.81) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL26606570 0.78 NPC1 (0.69) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL26606534 0.77 RAB9A (0.51) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL26606553 0.77 RAB9A (0.67) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL26606550 0.77 RAB9A (0.66) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL24845490 0.76 RAB9A (0.76) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL26606459 0.76 IRAK4 (0.48) RAB9ANPC1SMN1; SMN2PKMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240116897-A1 BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2024-04-11 — — US disclosed
EP-4269394-A1 BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT Korea Research Institute of Chemical Technology (KR) 2023-11-01 — — EP disclosed
CN-116829542-A Benzothiazole and benzimidazole derivatives, pharmaceutically acceptable salts, preparation method thereof and pharmaceutical composition containing same as active ingredient 韩国化学研究院 2023-09-29 — — CN disclosed
WO-2022164135-A1 BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT 한국화학연구원 2022-08-04 — — 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-20240116897-A1 BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT SIRT7, SIRT1, BRD7 RAB9A 2738/4885NPC1 1296/4885SMN1; SMN2 2820/4885

“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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