SCHEMBL628621

SCHEMBL628621

CC(Br)C(=O)Nc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.61
▸ MAPT P10636 4/20 0.61
▸ MEN1 O00255 4/20 0.61
▸ KMT2A Q03164 4/20 0.61
▸ RXFP1 Q9HBX9 1/20 0.61
▸ POLB P06746 1/20 0.57
▸ GAA P10253 3/20 0.56
▸ ATM Q13315 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ HSD17B10 Q99714 3/20 0.54
▸ NAPRT Q6XQN6 1/20 0.54
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ HPGD P15428 3/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ HTT P42858 2/20 0.53
▸ HSP90AA1 P07900 2/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ TAAR1 Q96RJ0 1/20 0.53
▸ GPR55 Q9Y2T6 1/20 0.53
▸ MME P08473 1/20 0.53

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
SCHEMBL3682694 0.89 HTT (0.55) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL6864880 0.85 ALDH1A1 (0.63) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL5662256 0.84 SMN1; SMN2 (0.62) ALDH1A1SMN1; SMN2HPGDRAB9AHTT
SCHEMBL5662258 0.84 SMN1; SMN2 (0.62) ALDH1A1SMN1; SMN2HPGDRAB9AHTT
SCHEMBL17466180 0.84 HTT (0.65) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL27713744 0.84 HTT (0.65) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL18852431 0.83 ALDH1A1 (0.66) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL9886 0.83 ALDH1A1 (0.85) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL19425986 0.83 ALDH1A1 (0.85) ALDH1A1MAPTMEN1KMT2ARXFP1
SCHEMBL1800895 0.83 POLB (0.61) ALDH1A1MAPTMEN1KMT2ARXFP1

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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104119266-A Method for preparing carbazole from phenolic compound UNIV ZHEJIANG 2014-10-29 — — CN claimed
CN-118326019-A Mutant wells 牛津纳米孔科技公开有限公司 2024-07-12 — — CN disclosed
CN-118326018-A Mutant wells 牛津纳米孔科技公开有限公司 2024-07-12 — — CN disclosed
CN-118272512-A Mutant wells 牛津纳米孔科技公开有限公司 2024-07-02 — — CN disclosed
CN-118256605-A Mutant wells 牛津纳米孔科技公开有限公司 2024-06-28 — — CN disclosed
CN-116514944-A Mutant wells 牛津纳米孔科技公开有限公司 2023-08-01 — — CN disclosed
CN-116377044-A Methods and complexes for sequential translocation of two non-covalently bound complementary nucleic acid strands through a nanopore 牛津纳米孔科技公开有限公司 2023-07-04 — — CN disclosed
CN-116334200-A Method for determining polynucleotide characteristics using nanopores and complexes for use in the method 牛津纳米孔科技公开有限公司 2023-06-27 — — CN disclosed
US-11420944-B2 Voltage-dependent t-type calcium channel blocker NIPPON CHEMIPHAR CO., LTD. (JP) 2022-08-23 — — US disclosed
US-20190077767-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL BLOCKER NIPPON CHEMIPHAR CO., LTD. (JP) 2019-03-14 — — US disclosed
WO-1993025518-A1 NOVEL PROCESS FOR THE PREPARATION OF α-AMINOACYLANILIDES MERCK & CO., INC. (US) 1993-12-23 — — WO disclosed
EP-0488861-A1 Process for the preparation of alkoxylated aromatic compounds RHONE-POULENC CHIMIE (FR) 1992-06-03 — — EP disclosed
EP-0455545-A1 Process for the preparation of mono- or polyalkoxylated aromatic compounds RHONE-POULENC CHIMIE (FR) 1991-11-06 — — EP disclosed
EP-0434516-A2 Process for the preparation of mono- or poly-alkoxylated aromatic compounds RHONE-POULENC CHIMIE (FR) 1991-06-26 — — EP disclosed
EP-0434517-A2 Process for the preparation of mono- or poly-alkoxylated aromatic compounds RHONE-POULENC CHIMIE (FR) 1991-06-26 — — EP disclosed
US-4608081-A SELECTIVITY AGAINST GRASSES KANESHO COMPANY LIMITED (JP) 1986-08-26 — — US disclosed
US-4435419-A Method of treating depression using azabicyclohexanes AMERICAN CYANAMID COMPANY (US) 1984-03-06 — — US disclosed
US-4102924-A REACTING ACYLAMINO-ARYLS WITH HALO-ARYLS BAYER AKTIENGESELLSCHAFT (DE) 1978-07-25 — — US disclosed
US-4017631-A MICROBIOCIDES JANSSEN PHARMACEUTICA N.V. (BE) 1977-04-12 — — US disclosed
US-3991202-A ANTIMICROBIALS JANSSEN PHARMACEUTICA N.V. (BE) 1976-11-09 — — 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 (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-11420944-B2 Voltage-dependent t-type calcium channel blocker CACNA1I, CACNA1G, CACNA1E ALDH1A1 3247/4885MAPT 574/4885MEN1 2133/4885
US-20190077767-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL BLOCKER CACNA1I, CACNA1G, CACNA1E ALDH1A1 3220/4885MAPT 707/4885MEN1 1995/4885

“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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