SCHEMBL1781864

SCHEMBL1781864

CN1CCC(NC(=O)c2ccc(N)cc2F)CC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 1/20 0.55
HRH3 Q9Y5N1 2/20 0.55
CRBN Q96SW2 1/20 0.53
PIK3CA P42336 1/20 0.49
MTOR P42345 1/20 0.49
DYRK1A Q13627 4/20 0.48
WNT1 P04628 3/20 0.48
CDK1 P06493 2/20 0.48
CDK2 P24941 2/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
BRD4 O60885 2/20 0.46
TAF1 P21675 1/20 0.46
CECR2 Q9BXF3 1/20 0.46
BRD9 Q9H8M2 1/20 0.46
ALDH1A1 P00352 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
SCHEMBL31567826 0.89 CRBN (0.60) HRH3CRBNMEN1KMT2AALDH1A1
SCHEMBL7987541 0.89 CRBN (0.60) HRH3CRBNMEN1KMT2AALDH1A1
SCHEMBL18010687 0.86 ACKR3 (0.55) ACKR3HRH3DYRK1AWNT1CDK1
SCHEMBL13498283 0.86 CRBN (0.57) HRH3CRBNKMT2AALDH1A1
SCHEMBL4514465 0.85 ACKR3 (0.54) ACKR3HRH3PIK3CAMTORDYRK1A
SCHEMBL13880681 0.85 CRBN (0.54) ACKR3CRBNMEN1KMT2ATAF1
SCHEMBL1781337 0.84 ACKR3 (0.49) ACKR3HRH3PIK3CAMTORDYRK1A
SCHEMBL14094313 0.84 HPGD (0.55) HRH3CRBN
SCHEMBL17996268 0.83 ACKR3 (0.52) ACKR3HRH3CDK1CDK2MEN1
SCHEMBL13880742 0.82 CRBN (0.57) CRBNMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12187686-B2 BRD4-JAK2 inhibitors H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2025-01-07 US disclosed
US-11643396-B2 BRD4-kinase inhibitors as cancer therapeutics H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2023-05-09 US disclosed
US-11643396-B2 BRD4-kinase inhibitors as cancer therapeutics H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2023-05-09 US disclosed
US-20210355088-A1 BRD4-JAK2 INHIBITORS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2021-11-18 US disclosed
US-20210355088-A1 BRD4-JAK2 INHIBITORS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2021-11-18 US disclosed
US-20200407328-A1 BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2020-12-31 US disclosed
US-10738016-B2 BRD4-kinase inhibitors as cancer therapeutics H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2020-08-11 US disclosed
US-10336734-B2 Inhibitors of ACK1/TNK2 tyrosine kinase H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2019-07-02 US disclosed
US-20190055203-A1 POTENT DUAL BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2019-02-21 US disclosed
US-20180215738-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2018-08-02 US disclosed
CN-101448830-A Dihydropteridine compounds as anti proliferative agents ASTRAZENECA AB (SE) 2009-06-03 CN disclosed
EP-2046793-A2 FUSED PYRIMIDO COMPOUNDS AstraZeneca AB (SE) 2009-04-15 EP disclosed
WO-2009042711-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-04-02 WO disclosed
EP-2029599-A1 DIHYDROPTERIDINE COMPOUNDS AS ANTI PROLIFERATIVE AGENTS Astra Zeneca AB (SE) 2009-03-04 EP disclosed
WO-2008040951-A1 COMPOUNDS ASTRAZENECA AB (SE) 2008-04-10 WO disclosed
WO-2008040951-A1 COMPOUNDS ASTRAZENECA AB (SE) 2008-04-10 WO disclosed
WO-2008003958-A2 FUSED PYRIMIDO COMPOUNDS ASTRAZENECA AB (SE) 2008-01-10 WO disclosed
US-20080009482-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2008-01-10 US disclosed
WO-2007135374-A1 DIHYDROPTERIDINE COMPOUNDS AS ANTI PROLIFERATIVE AGENTS ASTRAZENECA AB (SE) 2007-11-29 WO disclosed
WO-2007135374-A1 DIHYDROPTERIDINE COMPOUNDS AS ANTI PROLIFERATIVE AGENTS ASTRAZENECA AB (SE) 2007-11-29 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 (9 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-20200407328-A1 BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS BRD4, BICRA, BRDT ACKR3 1556/4885HRH3 894/4885CRBN 3103/4885
US-10738016-B2 BRD4-kinase inhibitors as cancer therapeutics BRD4, BICRA, BRDT ACKR3 1556/4885HRH3 894/4885CRBN 3103/4885
US-20210355088-A1 BRD4-JAK2 INHIBITORS BRD4, BICRA, JAK2 ACKR3 1043/4885HRH3 991/4885CRBN 1816/4885
US-20080009482-A1 NOVEL COMPOUNDS CYP11B2, CYP11B1, CYP46A1 ACKR3 2084/4885HRH3 2607/4885CRBN 3578/4885
US-10336734-B2 Inhibitors of ACK1/TNK2 tyrosine kinase TNK1, TNNI3K, TNK2 ACKR3 617/4885HRH3 1531/4885CRBN 3433/4885
US-20190055203-A1 POTENT DUAL BRD4-KINASE INHIBITORS AS CANCER THERAPEUTICS BRD4, BICRA, BRDT ACKR3 2696/4885HRH3 1909/4885CRBN 1774/4885
US-11643396-B2 BRD4-kinase inhibitors as cancer therapeutics BRD4, BICRA, BRDT ACKR3 1556/4885HRH3 894/4885CRBN 3103/4885
US-20180215738-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE TNK1, TNNI3K, TNK2 ACKR3 617/4885HRH3 1531/4885CRBN 3433/4885
US-12187686-B2 BRD4-JAK2 inhibitors BRD4, BICRA, JAK2 ACKR3 1043/4885HRH3 991/4885CRBN 1816/4885

“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.