SCHEMBL6726679

SCHEMBL6726679

CC(C)=CC1CN(Cc2ccccc2)CCN1Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.50
ALDH1A1 P00352 2/20 0.49
FUCA1 P04066 2/20 0.46
LMNA P02545 2/20 0.45
MC4R P32245 1/20 0.45
GRIN1 Q05586 1/20 0.45
GRIN2B Q13224 1/20 0.45

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
SCHEMBL2089277 0.82 SIGMAR1 (0.53) SIGMAR1ALDH1A1LMNAMC4R
SCHEMBL2089705 0.82 SIGMAR1 (0.46) SIGMAR1ALDH1A1LMNAMC4R
SCHEMBL2089692 0.82 SIGMAR1 (0.46) SIGMAR1ALDH1A1LMNAMC4R
SCHEMBL4292791 0.81 SIGMAR1 (0.52) SIGMAR1ALDH1A1LMNAMC4R
SCHEMBL4836946 0.81 SIGMAR1 (0.52) SIGMAR1ALDH1A1LMNAMC4R
SCHEMBL4842229 0.81 SIGMAR1 (0.52) SIGMAR1ALDH1A1LMNAMC4R
SCHEMBL7240008 0.81 SIGMAR1 (0.52) SIGMAR1ALDH1A1LMNAMC4R
Hydrochloric Acid SCHEMBL29257059 0.81 SIGMAR1 (0.52) SIGMAR1ALDH1A1LMNAMC4R
SCHEMBL13123337 0.79 ALDH1A1 (0.57) SIGMAR1ALDH1A1FUCA1LMNAMC4R
SCHEMBL27798980 0.78 SIGMAR1 (0.49) SIGMAR1ALDH1A1LMNAMC4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6747023-B1 INHIBITORS FOR ACTIVATED COAGULATION FACTOR X, COAGULATION SUPPRESSORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-08 US disclosed
US-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-29 US disclosed
EP-1104754-A1 NOVEL SULFONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-06-06 EP 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-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction F2, CYC1, SULT2A1 SIGMAR1 367/4885ALDH1A1 1316/4885FUCA1 534/4885

“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.