SCHEMBL19748903

SCHEMBL19748903

COCCOc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1Br

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.65
CYP2C9 P11712 1/20 0.65
TSHR P16473 1/20 0.65
CYP2C19 P33261 1/20 0.65
PARP1 P09874 14/20 0.51
AR P10275 2/20 0.51
LMNA P02545 1/20 0.50
ENPP1 P22413 1/20 0.45

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
SCHEMBL29655062 1.00 CYP3A4 (0.65) CYP3A4CYP2C9TSHRCYP2C19PARP1
SCHEMBL19748662 0.88 CYP3A4 (0.65) CYP3A4CYP2C9TSHRCYP2C19PARP1
SCHEMBL29655199 0.88 CYP3A4 (0.65) CYP3A4CYP2C9TSHRCYP2C19PARP1
SCHEMBL29654995 0.88 CYP3A4 (0.80) CYP3A4CYP2C9TSHRCYP2C19PARP1
SCHEMBL19748738 0.88 CYP3A4 (0.80) CYP3A4CYP2C9TSHRCYP2C19PARP1
SCHEMBL30089593 0.80 CYP3A4 (0.56) CYP3A4CYP2C9TSHRCYP2C19PARP1
SCHEMBL19748797 0.80 CYP3A4 (0.56) CYP3A4CYP2C9TSHRCYP2C19PARP1
SCHEMBL29655241 0.80 CYP3A4 (0.61) CYP3A4CYP2C9TSHRCYP2C19PARP1
SCHEMBL29655106 0.80 CYP3A4 (0.61) CYP3A4CYP2C9TSHRCYP2C19PARP1
SCHEMBL19748913 0.80 CYP3A4 (0.61) CYP3A4CYP2C9TSHRCYP2C19PARP1

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
US-12145925-B2 Phthalazine derivatives as inhibitors of PARP1, PARP2, and/or tubulin useful for the treatment of cancer ATLASMEDX, INC. (US) 2024-11-19 US disclosed
EP-3475272-B1 PHTHALAZINE DERIVATIVES AS INHIBITORS OF PARP1, PARP2 AND/OR TUBULIN USEFUL FOR THE TREATMENT OF CANCER UNIV CALIFORNIA (US) 2023-09-13 EP disclosed
US-20220402894-A1 Phthalazine Derivatives as Inhibitors of PARP1, PARP2, and/or Tubulin Useful for the Treatment of Cancer ATLASMEDX, INC. 2022-12-22 US disclosed
CN-109843874-B Phthalazine derivatives useful as inhibitors of PARP1, PARP2 and/or tubulin for the treatment of cancer 加利福尼亚大学董事会 2022-05-27 CN disclosed
US-11072600-B2 Phthalazine derivatives as inhibitors of PARP1, PARP2, and/or tubulin useful for the treatment of cancer THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-07-27 US disclosed
US-10640493-B2 Phthalazine derivatives as inhibitors of PARP1, PARP2, and/or tubulin useful for the treatment of cancer THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-05-05 US disclosed
US-20190352283-A1 Phthalazine Derivatives as Inhibitors of PARP1, PARP2, and/or Tubulin Useful for the Treatment of Cancer ATLASMEDX, INC. 2019-11-21 US disclosed
US-20190337928-A1 Phthalazine Derivatives as Inhibitors of PARP1, PARP2, and/or Tubulin Useful for the Treatment of Cancer ATLASMEDX, INC. 2019-11-07 US disclosed
EP-3475272-A1 PHTHALAZINE DERIVATIVES AS INHIBITORS OF PARP1, PARP2 AND/OR TUBULIN USEFUL FOR THE TREATMENT OF CANCER The Regents of The University of California (US) 2019-05-01 EP disclosed
WO-2017223516-A1 PHTHALAZINE DERIVATIVES AS INHIBITORS OF PARP1, PARP2 AND/OR TUBULIN USEFUL FOR THE TREATMENT OF CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-12-28 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 (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-20220402894-A1 Phthalazine Derivatives as Inhibitors of PARP1, PARP2, and/or Tubulin Useful for the Treatment of Cancer PARP2, PARP12, PARP1 CYP3A4 3102/4885CYP2C9 4189/4885TSHR 4610/4885
US-20190337928-A1 Phthalazine Derivatives as Inhibitors of PARP1, PARP2, and/or Tubulin Useful for the Treatment of Cancer PARP2, PARP12, PARP1 CYP3A4 3102/4885CYP2C9 4189/4885TSHR 4610/4885
US-10640493-B2 Phthalazine derivatives as inhibitors of PARP1, PARP2, and/or tubulin useful for the treatment of cancer PARP2, PARP12, PARP1 CYP3A4 3698/4885CYP2C9 4661/4885TSHR 4519/4885
US-11072600-B2 Phthalazine derivatives as inhibitors of PARP1, PARP2, and/or tubulin useful for the treatment of cancer PARP2, PARP12, PARP1 CYP3A4 3102/4885CYP2C9 4189/4885TSHR 4610/4885
US-12145925-B2 Phthalazine derivatives as inhibitors of PARP1, PARP2, and/or tubulin useful for the treatment of cancer PARP2, PARP12, PARP1 CYP3A4 3102/4885CYP2C9 4189/4885TSHR 4610/4885
US-20190352283-A1 Phthalazine Derivatives as Inhibitors of PARP1, PARP2, and/or Tubulin Useful for the Treatment of Cancer PARP2, PARP12, PARP1 CYP3A4 3698/4885CYP2C9 4661/4885TSHR 4519/4885

“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.