SCHEMBL6535998

SCHEMBL6535998

CC(C)Cc1ccc(-c2[c]ccc(C(C)(C)C)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
RXRA P19793 2/20 0.33
RXRB P28702 2/20 0.33
RXRG P48443 2/20 0.33
ATM Q13315 1/20 0.33
XDH P47989 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
TRPV1 Q8NER1 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL9600544 0.80 KIF11 (0.41) MEN1MAPTKMT2ATP53TSHR
SCHEMBL5736161 0.80 PTPN5 (0.34) TP53AKR1C2CYP2C9AKR1C3
SCHEMBL5521594 0.77 TSHR (0.45) MAPTTSHRRXRARXRBLMNA
SCHEMBL9598451 0.76 RXRA (0.42) RXRARXRBRXRGL3MBTL1NFKB1
SCHEMBL9600296 0.76 ALDH1A1 (0.31) MEN1MAPTKMT2ATSHR
SCHEMBL7647650 0.76 MEN1 (0.35) MEN1POLBKMT2A
SCHEMBL9600261 0.76 KCNH2 (0.36) MEN1POLBMAPTKMT2AL3MBTL1
SCHEMBL1371629 0.75 KIF11 (0.38) MEN1KMT2ARXRARXRBL3MBTL1
SCHEMBL11206658 0.75 TP53 (0.56) MEN1POLBMAPTKMT2ATP53
SCHEMBL15067852 0.74 ALDH1A1 (0.39) MEN1POLBMAPTKMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1425015-A4 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL MYERS SQUIBB CO (US) 2004-12-15 EP claimed
EP-1425015-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-06-09 EP claimed
WO-2003015715-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-02-27 WO claimed
US-9777138-B2 Latent additive and composition containing latent additive ADEKA CORPORATION (JP) 2017-10-03 US disclosed
US-20150291772-A1 LATENT ADDITIVE AND COMPOSITION CONTAINING LATENT ADDITIVE ADEKA CORPORATION (JP) 2015-10-15 US disclosed
EP-1425015-A4 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL MYERS SQUIBB CO (US) 2004-12-15 EP disclosed
EP-1425015-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-06-09 EP disclosed
WO-2003015715-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-02-27 WO 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-20150291772-A1 LATENT ADDITIVE AND COMPOSITION CONTAINING LATENT ADDITIVE TCF7L2, LUC7L2, TLL2 MEN1 2849/4885POLB 2413/4885MAPT 4414/4885

“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.