SCHEMBL3107286

SCHEMBL3107286

CC(C)c1cccc2cc[c]nc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
GABRA1 P14867 3/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
HPGD P15428 2/20 0.38
TSHR P16473 2/20 0.38
GABRB2 P47870 2/20 0.38
FAAH O00519 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
GABRB1 P18505 1/20 0.38
PTGS1 P23219 1/20 0.38
SLC6A2 P23975 1/20 0.38
HTR2C P28335 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
HTR2B P41595 1/20 0.38
GABRA2 P47869 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
SCHEMBL2304470 0.75 METAP2 (0.38) LMNAALDH1A1METAP2
SCHEMBL14193973 0.73 METAP2 (0.55) LMNAGABRA1GABRG2GABRB3CYP1A2
SCHEMBL84502 0.71 PSMD14 (0.55) LMNACYP3A4TSHRCA1CA2
SCHEMBL31490195 0.71 PSMD14 (0.55) LMNACYP3A4TSHRCA1CA2
SCHEMBL1828724 0.71 CYP1A2 (0.37) LMNACYP1A2HPGDALDH1A1TDP1
SCHEMBL144188 0.71 METAP2 (0.52) LMNACYP1A2CYP3A4HPGDTSHR
SCHEMBL1828122 0.71 SMN1; SMN2 (0.36) LMNAHPGDTSHRKDM4EALDH1A1
SCHEMBL10879255 0.70 ESR1 (0.36) KDM4EALDH1A1METAP2SLC40A1
SCHEMBL4467203 0.70 MCHR1 (0.51) LMNACYP3A4BLMALDH1A1TDP1
SCHEMBL16568695 0.70 CA2 (0.38) GABRA1TSHRGABRB2CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100179109-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2010-07-15 US claimed
WO-2008124575-A1 RENIN INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 WO claimed

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-20100179109-A1 RENIN INHIBITORS REN, ACE, AGTR1 LMNA 1556/4885GABRA1 2771/4885GABRG2 2492/4885

“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.