SCHEMBL4567536

SCHEMBL4567536

CC(C)(C)c1ccc2c(c1C(C)(C)C)NCCC2

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 1/20 0.35
▸ TRPV1 Q8NER1 1/20 0.33
▸ MEN1 O00255 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CRHBP P24387 1/20 0.30
▸ CASP1 P29466 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ CASP7 P55210 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ CRHR2 Q13324 1/20 0.30

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
SCHEMBL22792682 0.89 PARP10 (0.35) —
SCHEMBL25590825 0.86 SRC (0.35) SRCTRPV1MEN1CYP1A2CRHBP
SCHEMBL20904391 0.81 SRC (0.34) SRCTRPV1
SCHEMBL10912802 0.79 SRC (0.46) SRCCASP1CASP7
SCHEMBL19511770 0.74 SRC (0.46) SRCMEN1CASP1CASP7KMT2A
SCHEMBL4567533 0.72 GRIA1 (0.41) TRPV1CASP1CASP7
SCHEMBL19103015 0.72 SRC (0.41) SRC
SCHEMBL22389361 0.72 GAA (0.33) SRCMEN1CYP1A2CRHBPCASP1
SCHEMBL3744568 0.71 SRC (0.38) SRCMEN1CASP1CASP7KMT2A
SCHEMBL20904541 0.70 SRC (0.31) SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9062043-B2 Fused tricyclic compounds as serine-threonine protein kinase and PARP modulators SENHWA BIOSCIENCES, INC. (TW) 2015-06-23 — — US disclosed
US-20120122804-A1 SUBSTITUTED QUINOBENZOXAZINE ANALOGS CYLENE PHARMACEUTICALS, INC. (US) 2012-05-17 — — US disclosed
US-20110263581-A1 FUSED TRICYCLIC COMPOUNDS AS SERINE-THREONINE PROTEIN KINASE AND PARP MODULATORS CYLENE PHARMACEUTICALS, INC. (US) 2011-10-27 — — US disclosed
US-7956064-B2 Fused tricyclic compounds as serine-threonine protein kinase and PARP modulators CYLENE PHARMACEUTICALS, INC. (US) 2011-06-07 — — US disclosed
US-20110112086-A1 PYRIDINONE ANALOGS CYLENE PHARMACEUTICALS, INC. (US) 2011-05-12 — — US disclosed
US-7910600-B2 Therapeutic kinase modulators CYLENE PHARMACEUTICALS, INC. (US) 2011-03-22 — — US disclosed
US-20110065687-A1 HYDRAZIDE COMPOUNDS AND USES THEREOF SENHWA BIOSCIENCES, INC. (TW) 2011-03-17 — — US disclosed
US-20100305136-A1 QUINOLONE ANALOGS DERIVATIZED WITH SULFONIC ACID, SULFONATE OR SULFONAMIDE SENHWA BIOSCIENCES, INC. (TW) 2010-12-02 — — US disclosed
US-7834180-B2 Methods of preparing quinolone analogs CYLENE PHARMACEUTICALS, INC. (US) 2010-11-16 — — US disclosed
US-7816524-B2 Methods of preparing quinolone analogs CYLENE PHARMACEUTICALS, INC. (US) 2010-10-19 — — US disclosed
US-20080318939-A1 METHODS FOR TREATING OPHTHALMIC DISORDERS CYLENE PHARMACEUTICALS, INC. 2008-12-25 — — US disclosed
US-20080318938-A1 METHODS FOR TREATING ABERRANT CELL PROLIFERATION DISORDERS CYLENE PHARMACEUTICALS, INC. 2008-12-25 — — US disclosed
US-20080261963-A1 SUBSTITUTED QUINOBENZOXAZINE ANALOGS CYLENE PHARMACEUTICALS, INC. 2008-10-23 — — US disclosed
US-7402579-B2 Quinobenzoxazine analogs and compositions CYLENE PHARMACEUTICALS, INC. (US) 2008-07-22 — — US disclosed
US-7381720-B2 Substituted quinobenzoxazine analogs CYLENE PHARMACEUTICALS, INC. (US) 2008-06-03 — — US disclosed
US-7354916-B2 Substituted quinobenzoxazine analogs CYLENE PHARMACEUTICALS (US) 2008-04-08 — — US disclosed
US-7326702-B2 Substituted quinobenzoxazine analogs CYLENE PHARMACEUTICALS, INC. (US) 2008-02-05 — — US disclosed
US-20070117770-A1 Human ribosomal DNA (rDNA) and ribosomal RNA (rRNA) nucleic acids and uses thereof CYLENE PHARMACEUTICALS, INC. (US) 2007-05-24 — — US disclosed
US-20070043039-A1 Substituted quinobenzoxazine analogs CYLENE PHARMACEUTICALS, INC. 2007-02-22 — — US disclosed
US-20070032652-A1 Methods of preparing quinolone analogs SENHWA BIOSCIENCES, INC. (TW) 2007-02-08 — — 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 (11 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-20110263581-A1 FUSED TRICYCLIC COMPOUNDS AS SERINE-THREONINE PROTEIN KINASE AND PARP MODULATORS PARP1, PARP11, TNKS SRC 478/4885TRPV1 3730/4885MEN1 3970/4885
US-20080318939-A1 METHODS FOR TREATING OPHTHALMIC DISORDERS EYA3, UACA, ALDH1A2 SRC 4163/4885TRPV1 884/4885MEN1 743/4885
US-20080261963-A1 SUBSTITUTED QUINOBENZOXAZINE ANALOGS CYP3A5, UGT2B7, CYP2D6 SRC 1563/4885TRPV1 1659/4885MEN1 3714/4885
US-20120122804-A1 SUBSTITUTED QUINOBENZOXAZINE ANALOGS CYP3A5, UGT2B7, CYP2D6 SRC 1563/4885TRPV1 1659/4885MEN1 3714/4885
US-20070043039-A1 Substituted quinobenzoxazine analogs TP53, CCNY, ACIN1 SRC 702/4885TRPV1 4120/4885MEN1 3189/4885
US-20080318938-A1 METHODS FOR TREATING ABERRANT CELL PROLIFERATION DISORDERS MKI67, PCNA, CCNC SRC 812/4885TRPV1 4820/4885MEN1 1454/4885
US-20110065687-A1 HYDRAZIDE COMPOUNDS AND USES THEREOF EIF2AK2, DDX21, POLI SRC 4460/4885TRPV1 3700/4885MEN1 2881/4885
US-20100305136-A1 QUINOLONE ANALOGS DERIVATIZED WITH SULFONIC ACID, SULFONATE OR SULFONAMIDE NQO2, STS, SQOR SRC 2626/4885TRPV1 3661/4885MEN1 3586/4885
US-20110112086-A1 PYRIDINONE ANALOGS API5, BAD, PDXK SRC 3448/4885TRPV1 4301/4885MEN1 2464/4885
US-20070032652-A1 Methods of preparing quinolone analogs BAX, BAD, MCL1 SRC 3953/4885TRPV1 4805/4885MEN1 2224/4885
US-20070117770-A1 Human ribosomal DNA (rDNA) and ribosomal RNA (rRNA) nucleic acids and uses thereof NOP2, POLRMT, FBL SRC 3022/4885TRPV1 4802/4885MEN1 4012/4885

“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.

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