SCHEMBL12639504

SCHEMBL12639504

C#CC(=O)N(c1ccc(OC)cc1)C(C(=O)NC1CCCCC1)c1cccs1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.60
▸ LMNA P02545 1/20 0.60
▸ CYP3A4 P08684 3/20 0.56
▸ CYP2C9 P11712 3/20 0.56
▸ CYP2C19 P33261 3/20 0.56
▸ CYP2D6 P10635 2/20 0.56
▸ NPSR1 Q6W5P4 2/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ POLB P06746 1/20 0.53
▸ YAP1 P46937 1/20 0.53
▸ TEAD4 Q15561 1/20 0.53
▸ CRHBP P24387 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51
▸ THRB P10828 1/20 0.51
▸ ALOX12 P18054 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.49

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
SCHEMBL12639485 0.90 TDP1 (0.51) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL12639502 0.89 SMN1; SMN2 (0.66) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL12639430 0.89 MAPT (0.51) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL12639684 0.89 SMN1; SMN2 (0.61) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL12639687 0.89 POLB (0.67) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL12639406 0.88 MEN1 (0.54) MAPTLMNACYP3A4CYP2C19CYP2D6
SCHEMBL12639715 0.88 TDP1 (0.59) MAPTLMNACYP3A4CYP2C19CYP2D6
SCHEMBL12639491 0.88 SMN1; SMN2 (0.54) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL12639427 0.87 MEN1 (0.54) MAPTLMNACYP3A4CYP2C19CYP2D6
SCHEMBL14788383 0.87 POLB (0.56) MAPTLMNACYP3A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8519188-B2 Compounds which can be used for the treatment of cancers Marc-Henry Pitty (FR) 2013-08-27 — — US disclosed
US-8519188-B2 Compounds which can be used for the treatment of cancers Marc-Henry Pitty (FR) 2013-08-27 — — US disclosed
US-20110104162-A1 Compounds which can be used for the Treatment of Cancers CYTOMICS SYSTEMS (FR) 2011-05-05 — — US disclosed
US-20110104162-A1 Compounds which can be used for the Treatment of Cancers CYTOMICS SYSTEMS (FR) 2011-05-05 — — 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-20110104162-A1 Compounds which can be used for the Treatment of Cancers VHL, CYP11B2, SLC10A1 MAPT 2578/4885LMNA 2955/4885CYP3A4 133/4885

“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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