SCHEMBL4919209

SCHEMBL4919209

CCOC(=O)c1[c][nH]c2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.52
ALDH1A1 P00352 5/20 0.50
HTR6 P50406 2/20 0.50
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 1/20 0.50
HCRTR1 O43613 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
TUBB4A P04350 2/20 0.48
TUBB P07437 2/20 0.48
TUBA3C P0DPH7 2/20 0.48
TUBA1B P68363 2/20 0.48
TUBA4A P68366 2/20 0.48
TUBB4B P68371 2/20 0.48
TUBB3 Q13509 2/20 0.48
TUBB2A Q13885 2/20 0.48
TUBB8 Q3ZCM7 2/20 0.48
TUBA3E Q6PEY2 2/20 0.48
TUBA1A Q71U36 2/20 0.48

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
SCHEMBL2200929 0.85 TSHR (0.54) KDM4EALDH1A1MAPTSMN1; SMN2TSHR
SCHEMBL4919214 0.82 NR4A2 (0.50) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL16756178 0.81 CYP3A4 (0.51) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL289937 0.78 GABRA1 (0.46) KDM4EALDH1A1MAPTMEN1RAB9A
SCHEMBL8154831 0.77 ALDH1A1 (0.48) KDM4EALDH1A1HTR6MAPTSMN1; SMN2
SCHEMBL10846060 0.77 KDM4E (0.46) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL5473200 0.76 PBRM1 (0.46) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL1642680 0.74 KDM4E (0.42) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL1642667 0.73 ALDH1A1 (0.46) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL9587428 0.72 YTHDC1 (0.49) KDM4EALDH1A1MAPTSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200475-A1 4-Piperazinothieno[2,3-D] Pyrimidine Compounds As Platelet Aggregation Inhibitors PFIZER INC. 2008-08-21 US disclosed
EP-1866317-A1 4-PIPERAZINOTHIENO [2, 3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS Pharmacia & Upjohn Company LLC (US) 2007-12-19 EP disclosed
WO-2006103555-A1 4-PIPERAZINOTHIENO [2, 3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-10-05 WO disclosed
US-4611064-A Preparation of indole derivatives BASF AKTIENGESELLSCHAFT (DE) 1986-09-09 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 (1 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-20080200475-A1 4-Piperazinothieno[2,3-D] Pyrimidine Compounds As Platelet Aggregation Inhibitors PF4, TBXA2R, P2RY4 KDM4E 2775/4885ALDH1A1 849/4885HTR6 117/4885

“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.