SCHEMBL2175676

SCHEMBL2175676

CN(C)CC1Cc2ccccc2C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 10/20 1.00
ACHE P22303 4/20 0.55
CYP19A1 P11511 1/20 0.53

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
Hydrochloric Acid SCHEMBL2124625 0.98 METAP1 (1.00) METAP1ACHE
Hydrochloric Acid SCHEMBL30772482 0.98 METAP1 (1.00) METAP1ACHE
SCHEMBL8003063 0.83 METAP1 (0.71) METAP1ACHECYP19A1
SCHEMBL6271181 0.83 METAP1 (0.71) METAP1ACHECYP19A1
SCHEMBL2125675 0.83 METAP1 (0.71) METAP1ACHECYP19A1
SCHEMBL6270614 0.83 METAP1 (0.71) METAP1ACHECYP19A1
SCHEMBL14181702 0.83 METAP1 (0.73) METAP1ACHECYP19A1
Hydrochloric Acid SCHEMBL2125507 0.82 METAP1 (0.72) METAP1CYP19A1
Bromide SCHEMBL9065521 0.82 METAP1 (0.71) METAP1ACHECYP19A1
SCHEMBL3822940 0.81 METAP1 (0.68) METAP1ACHECYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8889615-B2 Methods for promoting epithelialization and healing of chronic wounds NEW YORK UNIVERSITY (US) 2014-11-18 US disclosed
US-8883839-B2 Tetraline and indane derivatives, pharmaceutical compositions containing them, and their use in therapy ABBOTT LABORATORIES (US) 2014-11-11 US disclosed
US-20120289463-A1 Compositions and Methods for Promoting Epithelialization and Wound Closure NEW YORK UNIVERSITY (US) 2012-11-15 US disclosed
US-20120040947-A1 TETRALINE AND INDANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY ABBOTT LABORATORIES (US) 2012-02-16 US disclosed
WO-2011082231-A1 COMPOSITIONS AND METHODS FOR PROMOTING EPITHELIALIZATION AND WOUND CLOSURE NEW YORK UNIVERSITY (US) 2011-07-07 WO disclosed
US-6054286-A DETECTING MODULATORS OF IMMUNE RESPONSE; INCUBATION OF PROTEIN KINASE C WITH MODULATOR AND ASCERTAINING PRESENCE OF MODULATING ACTIVITY TELIK, INC. (US) 2000-04-25 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-20120289463-A1 Compositions and Methods for Promoting Epithelialization and Wound Closure GSK3B, GSK3A, GSKIP METAP1 1231/4885ACHE 2786/4885CYP19A1 4583/4885
US-20120040947-A1 TETRALINE AND INDANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY SLC10A1, SUGT1, SLC10A2 METAP1 324/4885ACHE 1221/4885CYP19A1 1130/4885

“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.