SCHEMBL20722299

SCHEMBL20722299

CC1=C(c2ccccc2)C(c2ccccc2)=C(C)C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
PDE4B Q07343 1/20 0.39
CFTR P13569 1/20 0.39
GOPC Q9HD26 1/20 0.39
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
ALOX12 P18054 1/20 0.38
ACHE P22303 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
PTGS1 P23219 2/20 0.36
PTGS2 P35354 2/20 0.36
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
SLC22A2 O15244 1/20 0.35
SLC22A1 O15245 1/20 0.35
SLC22A3 O75751 1/20 0.35
SLC6A4 P31645 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
CYP2A6 P11509 1/20 0.34

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
SCHEMBL27933440 0.85 PTGS2 (0.43) ALDH1A1PDE4BCFTRGOPCKMT2A
SCHEMBL9281448 0.80 PTGS2 (0.47) ALDH1A1PDE4BCFTRGOPCLMNA
SCHEMBL27933484 0.79 CFTR (0.41) ALDH1A1PDE4BCFTRGOPCKMT2A
SCHEMBL27933609 0.77 CFTR (0.36) ALDH1A1CFTRGOPCKMT2AL3MBTL1
SCHEMBL11546612 0.77 MAOA (0.40) ALDH1A1TSHRKMT2APTGS2
Hydrochloric Acid SCHEMBL27546053 0.75 CFTR (0.34) ALDH1A1PDE4BCFTRGOPCLMNA
SCHEMBL27949026 0.74 PTGS2 (0.42) ALDH1A1PDE4BCFTRGOPCKMT2A
SCHEMBL26880221 0.72 ALDH1A1 (0.36) ALDH1A1CFTRGOPC
SCHEMBL532970 0.71 ALDH1A1 (0.67) ALDH1A1PDE4BLMNAKMT2ASLC22A2
SCHEMBL852224 0.71 ALDH1A1 (0.67) ALDH1A1PDE4BLMNAKMT2ASLC22A2

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-4700052-A1 HYBRID SUPPORTED METALLOCENE CATALYST AND METHOD FOR PREPARING POLYETHYLENE USING SAME LG Chem, Ltd. (KR) 2026-02-25 EP disclosed
US-11685711-B2 Carbon monoxide-releasing molecules triggered by physiological stimuli GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2023-06-27 US disclosed
US-20200283382-A1 CARBON MONOXIDE-RELEASING MOLECULES TRIGGERED BY PHYSIOLOGICAL STIMULI GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2020-09-10 US disclosed
WO-2019032879-A1 CARBON MONOXIDE-RELEASING MOLECULES TRIGGERED BY PHYSIOLOGICAL STIMULI GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2019-02-14 WO 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-20200283382-A1 CARBON MONOXIDE-RELEASING MOLECULES TRIGGERED BY PHYSIOLOGICAL STIMULI MB, CA2, HMOX2 ALDH1A1 3046/4885PDE4B 1444/4885CFTR 1913/4885
US-11685711-B2 Carbon monoxide-releasing molecules triggered by physiological stimuli MB, CA2, HMOX2 ALDH1A1 3046/4885PDE4B 1444/4885CFTR 1913/4885

“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.