SCHEMBL669493

SCHEMBL669493

CC(C)(C)c1ccccc1-n1cncn1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
RBP4 P02753 6/20 0.40
CYP2A6 P11509 1/20 0.40
ACHE P22303 1/20 0.38
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL19589422 0.85 CYP2A6 (0.37) LMNACYP2A6ACHECRHBPCRHR2
SCHEMBL9831326 0.82 ALDH1A1 (0.51) LMNACYP2A6ALDH1A1KDM4EPOLB
SCHEMBL21849635 0.78 POLB (0.39) CRHBPCRHR2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL21849199 0.78 POLB (0.37) LMNACYP2A6CRHBPCRHR2ALDH1A1
SCHEMBL27876564 0.78 ALDH1A1 (0.40) CRHBPCRHR2ALDH1A1POLBHCRTR1
SCHEMBL21849200 0.77 CYP2C9 (0.44) LMNAALDH1A1KDM4EPOLBCYP1A2
SCHEMBL26031154 0.77 CYP3A4 (0.43) LMNAALDH1A1KDM4EPOLBCYP1A2
SCHEMBL26144282 0.77 CRHBP (0.47) CRHBPCRHR2ALDH1A1KDM4E
SCHEMBL25489039 0.77 CYP1A2 (0.43) RBP4CYP2A6CRHBPCRHR2ALDH1A1
SCHEMBL2917479 0.76 LMNA (0.43) LMNACYP2A6ACHEALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012024132-A2 SOLUTION-PROCESSABLE ELECTRON-TRANSPORT MATERIALS AND RELATED ORGANIC OPTOELECTRONIC DEVICES UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2012-02-23 WO claimed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-20230242531-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-08-03 US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 US disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 US disclosed
US-20200102311-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2020-04-02 US disclosed
US-20100286147-A1 FUNGICIDAL AMIDES E.I. DUPONT DE NEMOURS AND COMPANY (US) 2010-11-11 US disclosed
US-20100286147-A1 FUNGICIDAL AMIDES E.I. DUPONT DE NEMOURS AND COMPANY (US) 2010-11-11 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 (6 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-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP LMNA 1308/4885RBP4 606/4885CYP2A6 747/4885
US-20230242531-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP LMNA 1845/4885RBP4 506/4885CYP2A6 1010/4885
US-20100286147-A1 FUNGICIDAL AMIDES NAT1, NOX1, CBR1 LMNA 3769/4885RBP4 4884/4885CYP2A6 225/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP LMNA 1308/4885RBP4 606/4885CYP2A6 747/4885
US-20200102311-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP LMNA 1845/4885RBP4 506/4885CYP2A6 1010/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP LMNA 1308/4885RBP4 606/4885CYP2A6 747/4885

“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.