SCHEMBL18243975

SCHEMBL18243975

[O]CCCc1cccc(C(Cl)(Cl)C(Cl)(Cl)C(Cl)(Cl)C(Cl)(Cl)Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 1/20 0.36
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ ACP3 P15309 1/20 0.33
▸ PGK1 P00558 2/20 0.33
▸ PGK2 P07205 2/20 0.33
▸ HTR2B P41595 1/20 0.32
▸ DPP4 P27487 1/20 0.32
▸ DAO P14920 1/20 0.31
▸ MIF P14174 1/20 0.31
▸ CNR1 P21554 1/20 0.30
▸ S1PR1 P21453 1/20 0.30
▸ GRK5 P34947 1/20 0.30
▸ CDK8 P49336 1/20 0.30
▸ S1PR5 Q9H228 1/20 0.30

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
SCHEMBL18242566 0.95 HDAC1 (0.37) TAAR1HDAC1HDAC8ACP3PGK1
SCHEMBL18241981 0.95 TAAR1 (0.37) TAAR1HDAC1HDAC8ACP3PGK1
SCHEMBL18242626 0.91 HDAC1 (0.38) TAAR1HDAC1HDAC8ACP3PGK1
SCHEMBL18242739 0.90 TAAR1 (0.38) TAAR1HDAC1HDAC8ACP3PGK1
SCHEMBL18242764 0.89 TAAR1 (0.39) TAAR1HDAC1HDAC8ACP3PGK1
SCHEMBL18244182 0.85 TAAR1 (0.39) TAAR1HDAC1HDAC8ACP3PGK1
SCHEMBL18244037 0.84 TAAR1 (0.36) TAAR1HDAC1HDAC8ACP3MIF
SCHEMBL18242981 0.84 HDAC1 (0.40) TAAR1HDAC1HDAC8ACP3PGK1
SCHEMBL18242348 0.83 ACP3 (0.37) TAAR1ACP3PGK1PGK2HTR2B
SCHEMBL18244154 0.82 TAAR1 (0.41) TAAR1HDAC1HDAC8ACP3PGK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-22 — — US disclosed
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2016-11-24 — — 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-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical CBR1, HAO2, CBR3 TAAR1 1102/4885HDAC1 3660/4885HDAC8 3395/4885
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL CBR1, HAO2, CBR3 TAAR1 1102/4885HDAC1 3660/4885HDAC8 3395/4885

“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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