SCHEMBL4014702

SCHEMBL4014702

CC1(C)Oc2ccc(CN)cc2O1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.51
ALOX12 P18054 1/20 0.51
TSHR P16473 1/20 0.50
KIF11 P52732 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
CYP2A6 P11509 1/20 0.36
TAAR1 Q96RJ0 3/20 0.35
HRH3 Q9Y5N1 1/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
MITF O75030 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL11888425 0.85 TAAR1 (0.53) ALOX15ALOX12TSHRKIF11CYP1A2
SCHEMBL9588776 0.82 ALOX15 (0.53) ALOX15ALOX12TSHRKIF11SMN1; SMN2
SCHEMBL10769004 0.80 KIF11 (0.41) ALOX15ALOX12KIF11CYP2A6TAAR1
SCHEMBL28231963 0.80 ALOX15 (0.51) ALOX15ALOX12TSHRKIF11SMN1; SMN2
SCHEMBL3755915 0.80 CTNNB1 (0.41) KIF11NPC1RAB9ACYP2A6LOXL2
SCHEMBL25084169 0.80 ALOX15 (0.55) ALOX15ALOX12TSHRKIF11SMN1; SMN2
SCHEMBL31139932 0.80 CTNNB1 (0.41) KIF11NPC1RAB9ACYP2A6LOXL2
SCHEMBL11630777 0.80 ALOX15 (0.51) ALOX15ALOX12TSHRKIF11SMN1; SMN2
SCHEMBL31009079 0.80 ALOX15 (0.55) ALOX15ALOX12TSHRKIF11SMN1; SMN2
SCHEMBL2472068 0.79 PDPK1 (0.37) ALOX15ALOX12TSHRKIF11SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019178547-A1 BENZOXAZINE POLYMERS AND METHODS OF MAKING AND USING THE SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-09-19 WO disclosed
CN-1993323-B Indole, indazole or indoline derivatives HOFFMANN LA ROCHE 2011-04-20 CN disclosed
US-20090247516-A1 3- (BENZO [D] [1,3] DIOXOL-5-YLMETHYL) -4- (THIO) OXO-2- (THIO) OXO-AZOLIDIN-5-YLIDENE DERIVATIVES AS ANTIBACTERIAL AGENTS KOTNIK MIHA 2009-10-01 US disclosed
EP-2074124-A1 3- (BENZO [D][1,3]DIOXOL-5-YLMETHYL) -4- (THIO) OXO-2- (THIO) OXO-AZOLIDIN-5-YLIDENE DERIVATIVES AS ANTIBACTERIAL AGENTS Lek Pharmaceuticals D.D. (SI) 2009-07-01 EP disclosed
EP-1916249-A1 3-(benzo[d][1,3]dioxol-5-ylmethyl)-4-(thio)oxo-2-(thio)oxo-azolidin-5-ylidene derivatives as antibacterial agents LEK Pharmaceuticals D.D. (SI) 2008-04-30 EP disclosed
WO-2008043733-A1 3- (BENZO [D] [1,3] DIOXOL-5-YLMETHYL) -4- (THIO) OXO-2- (THIO) OXO-AZOLIDIN-5-YLIDENE DERIVATIVES AS ANTIBACTERIAL AGENTS LEK PHARMACEUTICAL D.D. (SI) 2008-04-17 WO disclosed
CN-1993323-A Indole, indazole or indoline derivatives HOFFMANN LA ROCHE (CH) 2007-07-04 CN 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-20090247516-A1 3- (BENZO [D] [1,3] DIOXOL-5-YLMETHYL) -4- (THIO) OXO-2- (THIO) OXO-AZOLIDIN-5-YLIDENE DERIVATIVES AS ANTIBACTERIAL AGENTS XDH, TXLNA, Q6ZSR9 ALOX15 3078/4885ALOX12 2191/4885TSHR 279/4885

“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.