SCHEMBL6628548

SCHEMBL6628548

CCOc1cccc2c1OC1(C=C2)N(C)c2ccc(N3C(=O)CCC3=O)cc2C1(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
MAPT P10636 6/20 0.36
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
GAA P10253 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
LMNA P02545 2/20 0.36
HSD17B10 Q99714 2/20 0.36
ALPG P10696 1/20 0.36
RECQL P46063 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TP53 P04637 1/20 0.36
ALOX15 P16050 1/20 0.36
GFER P55789 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPK1 P28482 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP3A4 P08684 1/20 0.30
CYP19A1 P11511 1/20 0.30
CYP11B1 P15538 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
SCHEMBL6628094 0.90 MAPT (0.39) POLBMAPTMEN1KMT2AGAA
SCHEMBL6628966 0.87 MAPT (0.39) MAPTMEN1KMT2AGAANPSR1
SCHEMBL6627640 0.84 MAPT (0.43) MAPTMEN1KMT2AGAANPSR1
SCHEMBL6628929 0.83 GAA (0.38) MAPTMEN1KMT2AGAANPSR1
SCHEMBL8680550 0.82 GAA (0.40) POLBMAPTMEN1KMT2AGAA
SCHEMBL8682635 0.81 MAPT (0.51) POLBMAPTMEN1KMT2AGAA
SCHEMBL8681107 0.81 MAPT (0.41) POLBMAPTMEN1KMT2AGAA
SCHEMBL6628087 0.80 MEN1 (0.36) POLBMAPTMEN1KMT2AGAA
SCHEMBL6628341 0.78 MEN1 (0.44) POLBMAPTMEN1KMT2AGAA
SCHEMBL6627669 0.77 MEN1 (0.38) MAPTMEN1KMT2AGAANPSR1

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
EP-1299391-B1 INDOLINOSPIROPYRAN COMPOUNDS AND METHODS FOR THEIR MANUFACTURE JOHNSON & JOHNSON VISION CARE (US) 2004-12-29 EP disclosed
US-6803471-B2 USEFUL AS PHOTOCHROMIC COMPOUNDS; COVALENTLY ATTACHED TO WANG RESINS AND METHOD OF ATTACHING; OPHTHALMIC LENSES JOHNSON & JOHNSON VISION CARE, INC. 2004-10-12 US disclosed
US-6521753-B1 Indolinospiropyran compounds and methods for their manufacture JOHNSON & JOHNSON VISION CARE, INC. 2003-02-18 US disclosed
US-20020087010-A1 Indolinospiropyran compounds and methods for their manufacture ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2002-07-04 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-20020087010-A1 Indolinospiropyran compounds and methods for their manufacture DHPS, IDO1, INMT POLB 2941/4885MAPT 537/4885MEN1 3140/4885

“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.