SCHEMBL7066319

SCHEMBL7066319

CN(C(=O)O)[C@H](Cc1ccccc1)C(=O)NCCCO

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.52
TSHR P16473 1/20 0.52
CCR3 P51677 1/20 0.50
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 1/20 0.47
MMP8 P22894 1/20 0.45
LMNA P02545 1/20 0.43
TMEM97 Q5BJF2 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
CNR1 P21554 1/20 0.43
KDM4A O75164 1/20 0.42

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
SCHEMBL6323738 0.84 REN (0.46) CYP3A4TSHRCCR3CYP2D6CYP2C9
SCHEMBL9551243 0.80 KMT2A (0.51) CYP3A4TSHRCYP2D6CYP2C9CYP2C19
SCHEMBL22316481 0.77 NAAA (0.55) CYP3A4TSHRCYP2D6CYP2C9CYP2C19
SCHEMBL3648776 0.76 CYP1A2 (0.52) KMT2A
SCHEMBL2235914 0.76 NAAA (0.57) CYP2D6CYP2C9CYP2C19KMT2A
SCHEMBL2235923 0.76 NAAA (0.57) CYP2D6CYP2C9CYP2C19KMT2A
SCHEMBL5600745 0.76 CCR3 (0.56) CYP3A4TSHRCCR3
SCHEMBL5600734 0.76 CCR3 (0.56) CYP3A4TSHRCCR3
SCHEMBL5286587 0.75 EPOR (0.44) KMT2ATMEM97SIGMAR1
SCHEMBL6950840 0.75 HPGD (0.47) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030055261-A1 Compounds with growth hormone releasing properties HELSINN THERAPEUTICS (U.S.), INC. 2003-03-20 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-20030055261-A1 Compounds with growth hormone releasing properties GHRHR, GHSR, IGFBP1 CYP3A4 3623/4885TSHR 63/4885CCR3 2040/4885

“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.