SCHEMBL18784694

SCHEMBL18784694

OCCCn1c(-c2cncc(Cn3ccnc3)c2)nc2cc(F)c(Cl)cc21

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 10/20 0.39
CYP11B1 P15538 9/20 0.39
KCNH2 Q12809 1/20 0.38
CYP19A1 P11511 4/20 0.35
RHEB Q15382 1/20 0.34
CYP2A6 P11509 1/20 0.33
CYP2B6 P20813 1/20 0.33
BRD4 O60885 1/20 0.33
WDR5 P61964 1/20 0.33

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
SCHEMBL18784772 0.94 CYP11B2 (0.40) CYP11B2CYP11B1KCNH2CYP19A1RHEB
SCHEMBL18784781 0.92 CYP11B2 (0.40) CYP11B2CYP11B1KCNH2CYP19A1CYP2A6
SCHEMBL18784784 0.92 CYP11B2 (0.40) CYP11B2CYP11B1KCNH2CYP19A1BRD4
SCHEMBL29613088 0.90 CYP11B2 (0.41) CYP11B2CYP11B1KCNH2CYP19A1CYP2A6
SCHEMBL18784762 0.90 CYP11B2 (0.41) CYP11B2CYP11B1KCNH2CYP19A1CYP2A6
SCHEMBL18784706 0.90 CYP11B2 (0.42) CYP11B2CYP11B1KCNH2CYP19A1CYP2A6
SCHEMBL22609651 0.87 CYP11B2 (0.42) CYP11B2CYP11B1KCNH2CYP19A1
SCHEMBL18784812 0.85 KCNH2 (0.48) CYP11B2CYP11B1KCNH2CYP19A1RHEB
SCHEMBL18784718 0.85 CYP11B2 (0.49) CYP11B2CYP11B1KCNH2CYP19A1RHEB
SCHEMBL18784836 0.84 CYP11B2 (0.47) CYP11B2CYP11B1KCNH2CYP19A1RHEB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3162802-B1 2-(3-PYRIDINYL)-1H-BENZIMIDAZOLE DERIVATIVE COMPOUND AND MEDICINE CONTAINING SAME NIHON MEDIPHYSICS CO LTD (JP) 2020-08-19 EP disclosed
US-10358434-B2 2-(3-pyridinyl)-1H-benzimidazole derivative compound and medicament containing same NIHON MEDI-PHYSICS CO., LTD. (JP) 2019-07-23 US disclosed
US-20190169169-A1 2-(3-PYRIDINYL)-1H-BENZIMIDAZOLE DERIVATIVE COMPOUND AND MEDICAMENT CONTAINING SAME NIHON MEDI-PHYSICS CO., LTD. (JP) 2019-06-06 US disclosed
US-10189815-B2 2-(3-pyridinyl)-1H-benzimidazole derivative compound and medicine containing same NIHON MEDI-PHYSICS CO., LTD. (JP) 2019-01-29 US disclosed
US-20170158668-A1 2-(3-PYRIDINYL)-1H-BENZIMIDAZOLE DERIVATIVE COMPOUND AND MEDICINE CONTAINING SAME NIHON MEDI-PHYSICS CO., LTD. (JP) 2017-06-08 US disclosed
EP-3162802-A1 2-(3-PYRIDINYL)-1H-BENZIMIDAZOLE DERIVATIVE COMPOUND AND MEDICINE CONTAINING SAME Nihon Medi-Physics Co., Ltd. (JP) 2017-05-03 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 (4 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-20190169169-A1 2-(3-PYRIDINYL)-1H-BENZIMIDAZOLE DERIVATIVE COMPOUND AND MEDICAMENT CONTAINING SAME XDH, CYP11B2, GOT2 CYP11B2 2/4885CYP11B1 30/4885KCNH2 978/4885
US-20170158668-A1 2-(3-PYRIDINYL)-1H-BENZIMIDAZOLE DERIVATIVE COMPOUND AND MEDICINE CONTAINING SAME XDH, REN, BRD4 CYP11B2 6/4885CYP11B1 19/4885KCNH2 415/4885
US-10358434-B2 2-(3-pyridinyl)-1H-benzimidazole derivative compound and medicament containing same XDH, CYP11B2, GOT2 CYP11B2 2/4885CYP11B1 30/4885KCNH2 978/4885
US-10189815-B2 2-(3-pyridinyl)-1H-benzimidazole derivative compound and medicine containing same XDH, REN, BRD4 CYP11B2 6/4885CYP11B1 19/4885KCNH2 415/4885

“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.