SCHEMBL20601552

SCHEMBL20601552

CCCCCCCC(c1oc(CO)cc(=O)c1O)c1c[nH]c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC2 Q92769 2/20 0.47
HDAC10 Q969S8 2/20 0.47
HDAC11 Q96DB2 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
HDAC9 Q9UKV0 2/20 0.47
HDAC5 Q9UQL6 2/20 0.47
HDAC4 P56524 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
TEAD4 Q15561 11/20 0.46
GPR84 Q9NQS5 2/20 0.46
FFAR1 O14842 1/20 0.46
TEAD1 P28347 1/20 0.42
TEAD2 Q15562 1/20 0.42
TEAD3 Q99594 1/20 0.42

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
SCHEMBL20601560 1.00 HDAC3 (0.47) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL20624680 1.00 HDAC3 (0.47) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL20624608 1.00 HDAC3 (0.47) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL20624408 1.00 HDAC3 (0.47) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL20624406 1.00 HDAC3 (0.47) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL20624411 1.00 HDAC3 (0.47) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL20601510 0.99 TEAD4 (0.47) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL20601842 0.92 GPR84 (0.55) TEAD4GPR84FFAR1TEAD1TEAD2
SCHEMBL21887783 0.84 TEAD4 (0.49) TEAD4GPR84FFAR1TEAD1TEAD2
SCHEMBL21887350 0.80 FFAR1 (0.51) TEAD4GPR84FFAR1TEAD1TEAD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019003237-A1 INDOLYLKOJYL METHANE ANALOGUES, PROCESS OF PREPARATION THEREOF AND USE AS INHIBITOR OF CANCER CELL INVASION AND METASTASIS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2019-01-03 WO claimed
US-11180486-B2 Indolylkojyl methane analogues, process of preparation thereof and use as inhibitor of cancer cells invasion and metastasis COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-11-23 US disclosed
US-11180486-B2 Indolylkojyl methane analogues, process of preparation thereof and use as inhibitor of cancer cells invasion and metastasis COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-11-23 US disclosed
US-20200115365-A1 INDOLYLKOJYL METHANE ANALOGUES, PROCESS OF PREPARATION THEREOF AND USE AS INHIBITOR OF CANCER CELLS INVASION AND METASTASIS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2020-04-16 US disclosed
US-20200115365-A1 INDOLYLKOJYL METHANE ANALOGUES, PROCESS OF PREPARATION THEREOF AND USE AS INHIBITOR OF CANCER CELLS INVASION AND METASTASIS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2020-04-16 US disclosed
WO-2019003237-A1 INDOLYLKOJYL METHANE ANALOGUES, PROCESS OF PREPARATION THEREOF AND USE AS INHIBITOR OF CANCER CELL INVASION AND METASTASIS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2019-01-03 WO disclosed
WO-2019003237-A1 INDOLYLKOJYL METHANE ANALOGUES, PROCESS OF PREPARATION THEREOF AND USE AS INHIBITOR OF CANCER CELL INVASION AND METASTASIS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2019-01-03 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 (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-20200115365-A1 INDOLYLKOJYL METHANE ANALOGUES, PROCESS OF PREPARATION THEREOF AND USE AS INHIBITOR OF CANCER CELLS INVASION AND METASTASIS MIF, CYP11B1, CCNI HDAC3 3862/4885HDAC1 3200/4885HDAC2 3860/4885
US-11180486-B2 Indolylkojyl methane analogues, process of preparation thereof and use as inhibitor of cancer cells invasion and metastasis MIF, CYP11B1, MKI67 HDAC3 3870/4885HDAC1 3019/4885HDAC2 3858/4885

“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.