SCHEMBL22753233

SCHEMBL22753233

Cc1ccccc1N1CCN(c2ccccc2C)C1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 2/20 0.47
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALOX5 P09917 2/20 0.42
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MGLL Q99685 1/20 0.41
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41
SLC18A3 Q16572 1/20 0.40
AR P10275 2/20 0.39
LMNA P02545 2/20 0.39
MCOLN3 Q8TDD5 1/20 0.39
KDM4E B2RXH2 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ATM Q13315 1/20 0.39
TSHR P16473 1/20 0.38

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
SCHEMBL17885858 0.88 ADRB1 (0.42) ADRB1ALDH1A1HPGDSMN1; SMN2ALOX5
SCHEMBL17857367 0.88 ADRB1 (0.42) ADRB1ALDH1A1HPGDSMN1; SMN2ALOX5
SCHEMBL23729048 0.83 ALDH1A1 (0.39) ADRB1ALDH1A1HPGDSMN1; SMN2MGLL
SCHEMBL20693382 0.81 ADRB1 (0.40) ADRB1ALDH1A1HPGDSMN1; SMN2ALOX5
SCHEMBL16967089 0.81 ADRB1 (0.46) ADRB1ALDH1A1HPGDSMN1; SMN2ALOX5
SCHEMBL16307945 0.80 ALDH1A1 (0.47) ADRB1ALDH1A1HPGDSMN1; SMN2ALOX5
SCHEMBL18966917 0.78 MEN1 (0.45) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL20693377 0.77 ALDH1A1 (0.42) ADRB1ALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL22781105 0.77 ALDH1A1 (0.44) ADRB1ALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL20049846 0.76 ADRB1 (0.42) ADRB1ALDH1A1HPGDSMN1; SMN2ALOX5

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-3995524-A1 DUAL CURE SYSTEM FOR THE CHEMICAL FIXATION OF AN ANCHORING AGENT IN A DRILLED HOLE Hilti Aktiengesellschaft (LI) 2022-05-11 EP disclosed
EP-3995525-A1 MONOMER WITH TWO POLYMERISABLE GROUPS (FOR ROMP AND FOR RADICAL POLYMERISATION) AND ITS USE Hilti Aktiengesellschaft (LI) 2022-05-11 EP disclosed
US-20210332011-A1 TOTAL SYNTHESIS OF PROSTAGLANDIN J NATURAL PRODUCTS BY TEREORETENTIVE METATHESIS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-10-28 US disclosed
US-10857530-B2 Olefin metathesis catalysts UMICORE AG & CO. KG (DE) 2020-12-08 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-10857530-B2 Olefin metathesis catalysts ZDHHC7, ZDHHC2, OSBP ADRB1 4007/4885ALDH1A1 1629/4885HPGD 1836/4885
US-20210332011-A1 TOTAL SYNTHESIS OF PROSTAGLANDIN J NATURAL PRODUCTS BY TEREORETENTIVE METATHESIS PTGES, PTGES2, PTGIS ADRB1 716/4885ALDH1A1 3137/4885HPGD 29/4885

“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.