SCHEMBL12692529

SCHEMBL12692529

Cc1ccc(/C=C/c2nc3ccccc3c(=O)[nH]2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 11/20 1.00
▸ NPC1 O15118 10/20 1.00
▸ KDM4E B2RXH2 5/20 1.00
▸ CASP3 P42574 2/20 1.00
▸ SENP8 Q96LD8 2/20 1.00
▸ SENP7 Q9BQF6 2/20 1.00
▸ SENP6 Q9GZR1 2/20 1.00
▸ TUBB4A P04350 5/20 0.81
▸ TUBB P07437 5/20 0.81
▸ TUBA3C P0DPH7 5/20 0.81
▸ TUBA1B P68363 5/20 0.81
▸ TUBA4A P68366 5/20 0.81
▸ TUBB4B P68371 5/20 0.81
▸ TUBB3 Q13509 5/20 0.81
▸ TUBB2A Q13885 5/20 0.81
▸ TUBB8 Q3ZCM7 5/20 0.81
▸ TUBA3E Q6PEY2 5/20 0.81
▸ TUBA1A Q71U36 5/20 0.81
▸ TUBA1C Q9BQE3 5/20 0.81
▸ TUBB6 Q9BUF5 5/20 0.81

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
SCHEMBL1508835 0.90 TUBB4A (1.00) RAB9ANPC1KDM4ECASP3SENP8
SCHEMBL1508832 0.90 TUBB4A (1.00) RAB9ANPC1KDM4ECASP3SENP8
SCHEMBL12692460 0.86 TUBB4A (0.81) RAB9ANPC1KDM4ECASP3SENP8
SCHEMBL17890027 0.86 TUBB4A (0.81) RAB9ANPC1KDM4ECASP3SENP8
SCHEMBL17890029 0.86 TUBB4A (0.81) RAB9ANPC1KDM4ECASP3SENP8
SCHEMBL16448290 0.85 TUBB4A (0.74) RAB9ANPC1KDM4ECASP3SENP8
SCHEMBL17890024 0.85 TUBB4A (0.77) RAB9ANPC1KDM4ECASP3SENP8
SCHEMBL16448291 0.85 TUBB4A (0.74) RAB9ANPC1KDM4ECASP3SENP8
SCHEMBL17890026 0.85 TUBB4A (0.77) RAB9ANPC1KDM4ECASP3SENP8
SCHEMBL17890111 0.84 TUBB4A (0.72) RAB9ANPC1KDM4ECASP3SENP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120245166-A1 TREATMENT OF NEURODEGENERATIVE DISEASES, CAUSATION OF MEMORY ENHANCEMENT, AND ASSAY FOR SCREENING COMPOUNDS FOR SUCH SOUTHERN RESEARCH INSTITUTE (US) 2012-09-27 — — 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-20120245166-A1 TREATMENT OF NEURODEGENERATIVE DISEASES, CAUSATION OF MEMORY ENHANCEMENT, AND ASSAY FOR SCREENING COMPOUNDS FOR SUCH NFKBIA, NFRKB, TFEB RAB9A 2402/4885NPC1 467/4885KDM4E 1695/4885

“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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