SCHEMBL14853045

SCHEMBL14853045

COc1cc(C)c(C(C)C)c(C)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.41
POLB P06746 2/20 0.39
PDE2A O00408 1/20 0.35
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 3/20 0.33
NNMT P40261 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
DHFR P00374 1/20 0.31
PDE10A Q9Y233 1/20 0.31
TLR9 Q9NR96 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31

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
SCHEMBL15000323 0.84 RECQL (0.41) RECQLPOLBPDE2ALMNASMN1; SMN2
SCHEMBL22623125 0.82 RECQL (0.40) RECQLPOLBPDE2ALMNASMN1; SMN2
SCHEMBL18314713 0.81 PDE2A (0.33) RECQLPOLBPDE2ALMNASMN1; SMN2
SCHEMBL15000243 0.79 PDE10A (0.31) PDE10A
SCHEMBL14853184 0.78 RECQL (0.37) RECQLPOLBPDE2ALMNASMN1; SMN2
SCHEMBL15000234 0.77 PDE2A (0.31) PDE2ALMNASMN1; SMN2PDE10ATLR9
SCHEMBL12880861 0.74 RECQL (0.46) RECQLPOLBPDE2ALMNASMN1; SMN2
SCHEMBL14124200 0.74 RECQL (0.46) RECQLPOLBPDE2ALMNASMN1; SMN2
SCHEMBL10725037 0.74 ALDH1A1 (0.37) RECQLPOLBLMNASMN1; SMN2CYP1A2
SCHEMBL26517813 0.72 RECQL (0.41) RECQLPOLBPDE2ALMNASMN1; 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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024107445-A1 ENHANCEMENT OF THE EFFICACY OF SEROTONERGIC PSYCHEDELIC DRUGS IN THE TREATMENT OR PREVENTION OF CERTAIN NEUROPSYCHIATRIC DISORDERS THROUGH INHIBITION OF TYPE-9 PHOSPHODIESTERASES FREEDOM BIOSCIENCES, INC. (US) 2024-05-23 WO disclosed
US-11180494-B2 Substituted amino acids as integrin inhibitors PLIANT THERAPEUTICS, INC. (US) 2021-11-23 US disclosed
EP-2982674-B1 PYRIDINYLPYRAZOLOQUINOLINE COMPOUND EISAI R&D MAN CO LTD (JP) 2017-10-25 EP disclosed
US-9550776-B2 Pyridinylpyrazoloquinoline compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-01-24 US disclosed
US-9550776-B2 Pyridinylpyrazoloquinoline compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-01-24 US disclosed
US-20160289225-A1 PYRIDINYLPYRAZOLOQUINOLINE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-10-06 US disclosed
EP-2982674-A1 PYRIDINYLPYRAZOLOQUINOLINE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2016-02-10 EP disclosed
EP-2769980-B1 PYRAZOLOQUINOLINE DERIVATIVE AS PDE9 INHIBITORS EISAI R&D MAN CO LTD (JP) 2016-02-03 EP disclosed
WO-2014163146-A1 PYRIDINYLPYRAZOLOQUINOLINE COMPOUND エーザイ・アール・アンド・ディー・マネジメント株式会社 (JP) 2014-10-09 WO disclosed
EP-2769980-A1 PYRAZOLOQUINOLINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2014-08-27 EP disclosed
US-20130296352-A1 PYRAZOLOQUINOLINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-11-07 US disclosed
US-8563565-B2 Pyrazoloquinoline derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-10-22 US disclosed
US-20130143907-A1 PYRAZOLOQUINOLINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-06-06 US disclosed
WO-2013051639-A1 PYRAZOLOQUINOLINE DERIVATIVE エーザイ・アール・アンド・ディー・マネジメント株式会社 (JP) 2013-04-11 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 (4 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-20160289225-A1 PYRIDINYLPYRAZOLOQUINOLINE COMPOUNDS REN, KCNQ2, KCNQ1 RECQL 46/4885POLB 4017/4885PDE2A 106/4885
US-20130143907-A1 PYRAZOLOQUINOLINE DERIVATIVES PDE2A, PDE3A, PDE3B RECQL 240/4885POLB 3936/4885PDE2A 1/4885
US-11180494-B2 Substituted amino acids as integrin inhibitors ITGB6, ITGA1, ITGB1 RECQL 4829/4885POLB 4437/4885PDE2A 4637/4885
US-20130296352-A1 PYRAZOLOQUINOLINE DERIVATIVES PDE2A, PDE3A, PDE3B RECQL 240/4885POLB 3936/4885PDE2A 1/4885

“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.