SCHEMBL4965437

SCHEMBL4965437

CC(C)(C)OC(=O)N1CCC(c2ccc(C(=O)O)cc2)C1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 1/20 0.57
▸ HSD11B1 P28845 1/20 0.53
▸ USP30 Q70CQ3 1/20 0.51
▸ NAMPT P43490 1/20 0.51
▸ P2RY14 Q15391 1/20 0.50
▸ HPGDS O60760 1/20 0.50
▸ KMT2A Q03164 1/20 0.49
▸ TP53 P04637 3/20 0.48
▸ GPR119 Q8TDV5 4/20 0.48
▸ LMNA P02545 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ THRB P10828 1/20 0.47
▸ ABL1 P00519 1/20 0.46
▸ RIN1 Q13671 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ ATM Q13315 1/20 0.46

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
SCHEMBL1935816 0.94 HSD11B1 (0.61) PDE4BHSD11B1USP30NAMPTP2RY14
SCHEMBL226854 0.92 NAMPT (0.59) PDE4BNAMPTP2RY14HPGDSKMT2A
SCHEMBL15376005 0.89 RORC (0.49) PDE4BHSD11B1USP30NAMPTP2RY14
SCHEMBL9409412 0.88 PDE4B (0.59) PDE4BUSP30NAMPTHPGDSKMT2A
SCHEMBL23951735 0.88 TP53 (0.59) PDE4BUSP30NAMPTHPGDSTP53
SCHEMBL697513 0.88 TP53 (0.59) PDE4BUSP30NAMPTHPGDSTP53
SCHEMBL1751432 0.88 TP53 (0.59) PDE4BUSP30NAMPTHPGDSTP53
SCHEMBL18937651 0.86 PDE4B (0.60) PDE4BNAMPTHPGDSTP53GPR119
SCHEMBL12321142 0.86 PDE4B (0.60) PDE4BNAMPTKMT2ATP53GPR119
SCHEMBL1827362 0.85 PDE4B (0.58) PDE4BNAMPTKMT2AKDM4EMAPT

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170135994-A9 NAMPT INHIBITORS ABBVIE INC. (US) 2017-05-18 — — US disclosed
US-20160184281-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2016-06-30 — — US disclosed
US-20160184282-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2016-06-30 — — US disclosed
US-9193723-B2 NAMPT inhibitors ABBVIE INC. (US) 2015-11-24 — — US disclosed
US-9187472-B2 NAMPT inhibitors ABBVIE INC. (US) 2015-11-17 — — US disclosed
EP-2847192-A1 NAMPT INHIBITORS AbbVie Inc. (US) 2015-03-18 — — EP disclosed
CN-104428301-A NAMPT inhibitors ABBVIE INC 2015-03-18 — — CN disclosed
US-20140296235-A1 1H-BENZIMIDAZOLE-4-CARBOXAMIDES SUBSTITUTED WITH PHENYL AT THE 2-POSITION ARE POTENT PARP INHIBITORS ABBVIE INC. 2014-10-02 — — US disclosed
US-8697736-B2 1H-benzimidazole-4-carboxamides substituted with phenyl at the 2-position are potent PARP inhibitors ABBVIE INC. (US) 2014-04-15 — — US disclosed
US-20130303508-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 — — US disclosed
WO-2007041357-A1 1H-BENZIMIDAZOLE-4-CARBOXAMIDES SUBSTITUTED WITH PHENYL AT THE 2-POSITION ARE POTENT PARP INHIBITORS ABBOTT LABORATORIES (US) 2007-04-12 — — WO disclosed
EP-1031563-B1 SULFONYL DERIVATIVES DAIICHI SEIYAKU CO (JP) 2005-12-28 — — EP disclosed
EP-1577302-A1 NOVEL ETHYLENEDIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 — — EP disclosed
US-6747023-B1 INHIBITORS FOR ACTIVATED COAGULATION FACTOR X, COAGULATION SUPPRESSORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-08 — — US disclosed
US-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-29 — — US disclosed
US-20030232808-A1 Sulfonyl derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-12-18 — — US disclosed
US-6525042-B1 Inhibits an activated coagulation factor FXa; anticoagulant, antithrombotic DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-02-25 — — US disclosed
EP-1104754-A1 NOVEL SULFONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-06-06 — — EP disclosed
EP-1031563-A1 SULFONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-08-30 — — EP disclosed
EP-0604800-A1 4- 4- 4-(carboxyalkyl)-phenyl amino carbonyl -phenyl -piperedines as aggregation inhibitors Dr. Karl Thomae GmbH (DE) 1994-07-06 — — EP 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 (7 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-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction F2, CYC1, SULT2A1 PDE4B 4700/4885HSD11B1 2102/4885USP30 3755/4885
US-20130303508-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT PDE4B 770/4885HSD11B1 2533/4885USP30 4391/4885
US-20160184282-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT PDE4B 770/4885HSD11B1 2533/4885USP30 4391/4885
US-20140296235-A1 1H-BENZIMIDAZOLE-4-CARBOXAMIDES SUBSTITUTED WITH PHENYL AT THE 2-POSITION ARE POTENT PARP INHIBITORS PARP1, PARP2, PARP4 PDE4B 1613/4885HSD11B1 2566/4885USP30 2894/4885
US-20160184281-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT PDE4B 770/4885HSD11B1 2533/4885USP30 4391/4885
US-20030232808-A1 Sulfonyl derivatives SULT1E1, SULT2A1, SULT1A1 PDE4B 4532/4885HSD11B1 1592/4885USP30 3419/4885
US-20170135994-A9 NAMPT INHIBITORS NAMPT, NNMT, NAPRT PDE4B 770/4885HSD11B1 2533/4885USP30 4391/4885

“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.

Send feedback