SCHEMBL6182950

SCHEMBL6182950

Cc1cc(C)c2c(C(=O)N3CCC(N4CCC[C@@H](C(=O)N5CCOCC5)C4)CC3)cc(-c3ccccc3)nc2c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACACB O00763 11/20 0.55
ACACA Q13085 11/20 0.55
ALDH1A1 P00352 3/20 0.50
TSHR P16473 2/20 0.50
KDM4E B2RXH2 2/20 0.50
USP2 O75604 1/20 0.50
TP53 P04637 1/20 0.50
POLB P06746 1/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.50
LMNA P02545 1/20 0.49
CYP2C9 P11712 2/20 0.48
PLAUR Q03405 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 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
SCHEMBL977472 0.81 ACACB (0.71) ACACBACACA
SCHEMBL6183490 0.81 ALDH1A1 (0.58) ACACBACACAALDH1A1TSHRKDM4E
SCHEMBL6184472 0.79 ACACB (0.78) ACACBACACA
SCHEMBL977857 0.79 ACACB (0.51) ACACBACACAALDH1A1TSHRKDM4E
SCHEMBL6183609 0.78 ACACB (0.71) ACACBACACAALDH1A1TSHRLMNA
SCHEMBL6186087 0.78 ACACB (0.73) ACACBACACAALDH1A1TSHRKDM4E
SCHEMBL6183549 0.77 ACACB (0.53) ACACBACACAALDH1A1TSHRKDM4E
SCHEMBL6183582 0.76 ACACB (0.52) ACACBACACAALDH1A1TSHRKDM4E
SCHEMBL6185309 0.75 ACACB (0.53) ACACBACACAALDH1A1TSHRKDM4E
SCHEMBL6182411 0.75 ACACB (0.66) ACACBACACAALDH1A1TSHRKDM4E

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-6979741-B2 Acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2005-12-27 US disclosed
EP-1478437-B1 ACC INHIBITORS PFIZER PROD INC (US) 2005-08-31 EP disclosed
US-20030187254-A1 Acetyl-CoA carboxylase inhibitors PFIZER INC. 2003-10-02 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-20030187254-A1 Acetyl-CoA carboxylase inhibitors ACACA, ACACB, ACAT1 ACACB 2/4885ACACA 1/4885ALDH1A1 654/4885

“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.