SCHEMBL20898792

SCHEMBL20898792

[c]1ccnc(N2CCC3(CC2)COC3)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 11/20 0.37
CYP3A4 P08684 8/20 0.37
CYP2D6 P10635 7/20 0.37
TSHR P16473 6/20 0.37
CYP2C19 P33261 6/20 0.37
ALDH1A1 P00352 10/20 0.37
SMN1; SMN2 Q16637 6/20 0.37
HPGD P15428 6/20 0.37
MAPK1 P28482 5/20 0.37
CYP2C9 P11712 3/20 0.37
USP2 O75604 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
PDE9A O76083 1/20 0.34
CYP1A2 P05177 3/20 0.34
HRH3 Q9Y5N1 1/20 0.33
MAP3K12 Q12852 1/20 0.32
PIK3CA P42336 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
SCHEMBL20898740 0.91 HSD17B10 (0.36) HSD17B10CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL20899088 0.84 ALDH1A1 (0.33) HSD17B10CYP3A4CYP2D6ALDH1A1HPGD
SCHEMBL455110 0.78 PIK3CA (0.44) HSD17B10CYP2D6CYP2C19ALDH1A1SMN1; SMN2
SCHEMBL20898780 0.78 CYP11B1 (0.32) HSD17B10CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL20898829 0.78 PTPN11 (0.36) HSD17B10CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL1599784 0.76 HRH4 (0.38) TSHRALDH1A1SMN1; SMN2CYP1A2
SCHEMBL4831454 0.76 HRH4 (0.34)
SCHEMBL2324452 0.74 HRH4 (0.40) TSHRALDH1A1SMN1; SMN2CYP1A2
SCHEMBL20898865 0.74 ELOVL1 (0.41)
SCHEMBL20899052 0.72 LRRK2 (0.37) HSD17B10CYP3A4CYP2D6TSHRCYP2C19

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11040981-B2 Pyrrolotriazine compounds and methods of inhibiting TAM kinases SYROS PHARMACEUTICALS, INC. (US) 2021-06-22 US claimed
US-20210147431-A1 PYRROLOTRIAZINE COMPOUNDS AND METHODS OF INHIBITING TAM KINASES SYROS PHARMACEUTICALS INC (US) 2021-05-20 US claimed
EP-3694860-A1 PYRROLOTRIAZINE COMPOUNDS AND METHODS OF INHIBITING TAM KINASES Syros Pharmaceuticals, Inc. (US) 2020-08-19 EP claimed
WO-2019074962-A1 PYRROLOTRIAZINE COMPOUNDS AND METHODS OF INHIBITING TAM KINASES SYROS PHARMACEUTICALS, INC. (US) 2019-04-18 WO claimed
US-11040981-B2 Pyrrolotriazine compounds and methods of inhibiting TAM kinases SYROS PHARMACEUTICALS, INC. (US) 2021-06-22 US disclosed
US-20210147431-A1 PYRROLOTRIAZINE COMPOUNDS AND METHODS OF INHIBITING TAM KINASES SYROS PHARMACEUTICALS INC (US) 2021-05-20 US disclosed
US-20200317676-A1 PYRROLOTRIAZINE COMPOUNDS AND METHODS OF INHIBITING TAM KINASES SYROS PHARMACEUTICALS, INC. (US) 2020-10-08 US disclosed
EP-3694860-A1 PYRROLOTRIAZINE COMPOUNDS AND METHODS OF INHIBITING TAM KINASES Syros Pharmaceuticals, Inc. (US) 2020-08-19 EP disclosed
WO-2019074962-A1 PYRROLOTRIAZINE COMPOUNDS AND METHODS OF INHIBITING TAM KINASES SYROS PHARMACEUTICALS, INC. (US) 2019-04-18 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 (3 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-20210147431-A1 PYRROLOTRIAZINE COMPOUNDS AND METHODS OF INHIBITING TAM KINASES PLK2, MAP3K5, CAMKK2 HSD17B10 4498/4885CYP3A4 4135/4885CYP2D6 4525/4885
US-20200317676-A1 PYRROLOTRIAZINE COMPOUNDS AND METHODS OF INHIBITING TAM KINASES PLK2, MAP3K5, CAMKK2 HSD17B10 4498/4885CYP3A4 4135/4885CYP2D6 4525/4885
US-11040981-B2 Pyrrolotriazine compounds and methods of inhibiting TAM kinases PLK2, MAP3K5, CAMKK2 HSD17B10 4498/4885CYP3A4 4135/4885CYP2D6 4525/4885

“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.