SCHEMBL4417150

SCHEMBL4417150

O=C(CCn1cnc(-c2ccccc2)c1)N1CCN(c2cccc(Cl)c2)CC1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 8/20 0.64
HTR7 P34969 7/20 0.64
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
ALDH1A1 P00352 4/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
KDM4E B2RXH2 1/20 0.57
TSHR P16473 1/20 0.57
GRM5 P41594 1/20 0.51
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
HPGD P15428 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51

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
SCHEMBL4413980 0.91 HTR1A (0.59) HTR1AHTR7MEN1KMT2AALDH1A1
SCHEMBL4422360 0.85 HTR1A (0.64) HTR1AHTR7MEN1KMT2AALDH1A1
SCHEMBL4417691 0.84 MAPT (0.63) HTR1AHTR7MEN1KMT2AALDH1A1
SCHEMBL4430505 0.83 TSHR (0.52) HTR1AHTR7KMT2AALDH1A1SMN1; SMN2
SCHEMBL4419392 0.82 MAPK1 (0.57) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL4422101 0.81 HTR7 (0.56) HTR1AHTR7MEN1KMT2ALMNA
SCHEMBL4425296 0.81 HTR7 (0.57) HTR1AHTR7MEN1KMT2AALDH1A1
SCHEMBL4428558 0.80 MAPT (0.58) MEN1KMT2AALDH1A1SMN1; SMN2TSHR
SCHEMBL4419131 0.80 MAPT (0.58) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL4419917 0.79 TSHR (0.54) HTR1AHTR7ALDH1A1KDM4ETSHR

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-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-12-31 US claimed
US-8492384-B2 Imidazolylalkylcarbonyl derivatives as calcium channel modulators and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-23 US disclosed
US-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-12-31 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-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF CACNA1B, CACNA1C, ORAI1 HTR1A 1240/4885HTR7 816/4885MEN1 2657/4885

“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.