SCHEMBL22231981

SCHEMBL22231981

Cc1cc(N)c(Cl)c(N)c1-c1ccc(C(C)(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.44
▸ NPC1 O15118 5/20 0.38
▸ RAB9A P51151 5/20 0.38
▸ ALDH1A1 P00352 5/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ MITF O75030 1/20 0.37
▸ MAPT P10636 3/20 0.36
▸ GAA P10253 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ TSHR P16473 2/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ HSD17B2 P37059 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ KIF11 P52732 1/20 0.34
▸ LMNA P02545 1/20 0.34

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
SCHEMBL28549802 0.83 POLB (0.41) POLBALDH1A1KMT2AMAPTGAA
SCHEMBL28349136 0.79 NPC1 (0.44) POLBNPC1RAB9AALDH1A1KMT2A
SCHEMBL28542216 0.78 ALDH1A1 (0.37) POLBNPC1RAB9AALDH1A1KMT2A
SCHEMBL28465019 0.75 NPC1 (0.44) POLBNPC1RAB9AALDH1A1KMT2A
SCHEMBL23406367 0.71 NPC1 (0.44) POLBNPC1RAB9AALDH1A1KMT2A
SCHEMBL5953676 0.71 TSHR (0.52) POLBNPC1RAB9AALDH1A1KMT2A
SCHEMBL22232046 0.71 POLB (0.40) POLBNPC1RAB9AALDH1A1KMT2A
SCHEMBL28318702 0.70 NPC1 (0.50) NPC1RAB9AALDH1A1KMT2ATP53
SCHEMBL18161362 0.70 KIF11 (0.47) NPC1RAB9AALDH1A1KMT2ATP53
SCHEMBL2329256 0.70 POLB (0.61) POLBNPC1RAB9AALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220089523-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI INDUSTRIES LTD. (IN) 2022-03-24 — — US claimed
EP-3911629-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI Industries Ltd. (IN) 2021-11-24 — — EP claimed
CN-113454063-A 3-substituted phenylamidine compounds, preparation method and application thereof PI工业有限公司 2021-09-28 — — CN claimed
WO-2020148617-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI INDUSTRIES LTD. (IN) 2020-07-23 — — WO claimed
CN-112585145-B Polycyclic compound and organic light emitting device including the same 株式会社LG化学 2023-09-29 — — CN disclosed
CN-115448935-A Polycyclic aromatic compound 学校法人关西学院 2022-12-09 — — CN disclosed
US-20220089523-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI INDUSTRIES LTD. (IN) 2022-03-24 — — US disclosed
EP-3911629-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI Industries Ltd. (IN) 2021-11-24 — — EP disclosed
CN-113454063-A 3-substituted phenylamidine compounds, preparation method and application thereof PI工业有限公司 2021-09-28 — — CN disclosed
CN-112585145-A Polycyclic compound and organic light emitting device including the same 株式会社LG化学 2021-03-30 — — CN disclosed
WO-2020148617-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI INDUSTRIES LTD. (IN) 2020-07-23 — — 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-20220089523-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF H1-3, PRMT7, PFAS POLB 2700/4885NPC1 3413/4885RAB9A 1065/4885

“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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