SCHEMBL8073195

SCHEMBL8073195

O=C(NCc1ccccc1)C(Cl)Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.57
▸ MMP8 P22894 2/20 0.57
▸ GAA P10253 1/20 0.53
▸ MME P08473 1/20 0.53
▸ MEN1 O00255 3/20 0.52
▸ CYP2D6 P10635 2/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ ALDH1A1 P00352 2/20 0.51
▸ MAPT P10636 1/20 0.51
▸ MC4R P32245 1/20 0.51
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CA3 P07451 1/20 0.51
▸ CA4 P22748 1/20 0.51
▸ CA6 P23280 1/20 0.51
▸ CA5A P35218 1/20 0.51

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
SCHEMBL21538610 0.85 KMT2A (0.63) KMT2AMMP8MMEMEN1ALDH1A1
SCHEMBL21538582 0.85 KMT2A (0.63) KMT2AMMP8MMEMEN1ALDH1A1
SCHEMBL30476096 0.83 KMT2A (0.57) KMT2AMMP8GAAMMEMEN1
SCHEMBL12240252 0.83 KMT2A (0.57) KMT2AMMP8GAAMMEMEN1
SCHEMBL30175033 0.83 KMT2A (0.55) KMT2AMMP8GAAMMEMEN1
SCHEMBL10534524 0.82 KMT2A (0.59) KMT2AMMP8GAAMMEMEN1
SCHEMBL714386 0.82 KMT2A (0.59) KMT2AMMP8GAAMMEMEN1
SCHEMBL6522964 0.82 KMT2A (0.59) KMT2AMMP8GAAMMEMEN1
SCHEMBL714385 0.82 KMT2A (0.59) KMT2AMMP8GAAMMEMEN1
SCHEMBL10954350 0.81 KMT2A (0.61) KMT2AGAAMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117980285-A Process for producing purified dichloroacetic acid 住友化学株式会社 2024-05-03 — — CN claimed
US-4493727-A DICHLOROACETYL COMPOUND ESZAKMAGYARORSZAGI VEGYIMUVEK (HU) 1985-01-15 — — US claimed
CN-117980285-A Process for producing purified dichloroacetic acid 住友化学株式会社 2024-05-03 — — CN disclosed
EP-2484663-B1 PHENOLIC COMPOUND AND RECORDING MATERIAL NIPPON SODA CO (JP) 2019-07-17 — — EP disclosed
US-8431513-B2 Phenolic compound and recording material NIPPON SODA CO., LTD. (JP) 2013-04-30 — — US disclosed
US-20120204763-A1 PHENOLIC COMPOUND AND RECORDING MATERIAL NIPPON SODA CO., LTD. 2012-08-16 — — US disclosed
EP-2484663-A1 PHENOLIC COMPOUND AND RECORDING MATERIAL Nippon Soda Co., Ltd. (JP) 2012-08-08 — — EP disclosed
EP-0641204-B1 17-ETHERS AND THIOETHERS OF 4-AZA-STEROIDS MERCK & CO INC (US) 2000-08-16 — — EP disclosed
US-5693809-A PREGNANES FOR TREATING ALOPECIA, ACNE AND SKIN DISORDER MERCK & CO., INC. (US) 1997-12-02 — — US disclosed
US-5536727-A TREATMENT OF HYPERANDROGENIC DISEASES MERCK & CO., INC. (US) 1996-07-16 — — US disclosed
EP-0641204-A4 17-ETHERS AND THIOETHERS OF 4-AZA-STEROIDS. MERCK & CO INC (US) 1995-08-23 — — EP disclosed
EP-0641204-A1 17-ETHERS AND THIOETHERS OF 4-AZA-STEROIDS MERCK & CO. INC. (US) 1995-03-08 — — EP disclosed
WO-1993023040-A1 17-ETHERS AND THIOETHERS OF 4-AZA-STEROIDS MERCK & CO., INC. (US) 1993-11-25 — — WO disclosed
WO-1993023039-A1 SUBSTITUTED 4-AZA-5A-ANDROSTAN-ONES AS 5A-REDUCTASE INHIBITORS MERCK & CO., INC. (US) 1993-11-25 — — WO disclosed
US-4493727-A DICHLOROACETYL COMPOUND ESZAKMAGYARORSZAGI VEGYIMUVEK (HU) 1985-01-15 — — US disclosed
US-4033756-A PROTECTIVE COATINGS GULF RESEARCH & DEVELOPMENT COMPANY (US) 1977-07-05 — — US disclosed
US-3982923-A THIOCARBAMATE STAUFFER CHEMICAL COMPANY (US) 1976-09-28 — — US disclosed
US-3981716-A CORN, WEEDS STAUFFER CHEMICAL COMPANY (US) 1976-09-21 — — 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-20120204763-A1 PHENOLIC COMPOUND AND RECORDING MATERIAL OR10J3, OR51E2, H1-4 KMT2A 1509/4885MMP8 3218/4885GAA 4367/4885

“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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