SCHEMBL2471786

SCHEMBL2471786

O=c1cc(O)c2ccc3ccccc3c2s1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 5/20 0.50
CYP1B1 Q16678 5/20 0.50
CYP1A2 P05177 5/20 0.46
PTPN22 Q9Y2R2 1/20 0.41
TRPM4 Q8TD43 1/20 0.41
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NQO2 P16083 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ERN1 O75460 1/20 0.40
CYP2C19 P33261 2/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C9 P11712 1/20 0.39
POLB P06746 1/20 0.39
HPRT1 P00492 1/20 0.39

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
SCHEMBL2472396 0.75 MAOA (0.46) CYP1A2PTPN22NPC1MAPTRAB9A
SCHEMBL13085236 0.72 HPRT1 (0.57) CYP1A1CYP1B1CYP1A2PTPN22RAB9A
SCHEMBL30154374 0.72 HPRT1 (0.57) CYP1A1CYP1B1CYP1A2PTPN22RAB9A
SCHEMBL30819315 0.72 ALDH1A1 (0.55) TRPM4KDM4EMAPTNPSR1TDP1
SCHEMBL467777 0.72 ALDH1A1 (0.55) TRPM4KDM4EMAPTNPSR1TDP1
SCHEMBL11942389 0.71 HPRT1 (0.55) CYP1A1CYP1B1CYP1A2PTPN22KDM4E
SCHEMBL11545615 0.70 CYP1A2 (0.54) CYP1B1CYP1A2PTPN22TRPM4KDM4E
SCHEMBL22892555 0.69 POLB (0.43) CYP1A1CYP1B1CYP1A2PTPN22MAPT
SCHEMBL12070495 0.68 CYP1B1 (0.49) CYP1A1CYP1B1CYP1A2KDM4ENPC1
SCHEMBL22591653 0.68 PTPN22 (0.44) CYP1A1CYP1B1CYP1A2PTPN22NPC1

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
EP-2370422-B1 THIOCHROMENE DERIVATIVES AS HIF HYDROXYLASE INHIBITORS FIBROGEN INC (US) 2019-06-05 EP disclosed
US-9149476-B2 Thiochromene derivatives as HIF hydroxylase inhibitors FIBROGEN, INC. (US) 2015-10-06 US disclosed
US-20150182528-A1 THIOCHROMENE DERIVATIVES AS HIF HYDROXYLASE INHIBITORS FIBROGEN, INC. 2015-07-02 US disclosed
US-8927591-B2 Thiochromene derivatives as HIF hydroxylase inhibitors FIBROGEN, INC. (US) 2015-01-06 US disclosed
US-20110305776-A1 THIOCHROMENE DERIVATIVES AS HIF HYDROXYLASE INHIBITORS FIBROGEN, INC. (US) 2011-12-15 US disclosed
EP-2370422-A1 THIOCHROMENE DERIVATIVES AS HIP HYDROXYLASE INHIBITORS Fibrogen, Inc. (US) 2011-10-05 EP disclosed
US-7795299-B2 Neo-tanshinlactone and analogs as potent and selective anti-breast cancer agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2010-09-14 US disclosed
WO-2010056767-A1 THIOCHROMENE DERIVATIVES AS HIP HYDROXYLASE INHIBITORS FIBROGEN, INC. (US) 2010-05-20 WO disclosed
US-20090118356-A1 NEO-TANSHINLACTONE AND ANALOGS AS POTENT AND SELECTIVE ANTI-BREAST CANCER AGENTS NORTH CAROLINA STATE UNIVERSITY (US) 2009-05-07 US disclosed
US-7495026-B2 Neo-tanshinlactone and analogs as potent and selective anti-breast cancer agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2009-02-24 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 (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-20110305776-A1 THIOCHROMENE DERIVATIVES AS HIF HYDROXYLASE INHIBITORS HIF1AN, HIF1A, EGLN2 CYP1A1 220/4885CYP1B1 594/4885CYP1A2 406/4885
US-20090118356-A1 NEO-TANSHINLACTONE AND ANALOGS AS POTENT AND SELECTIVE ANTI-BREAST CANCER AGENTS BRCA1, CYP19A1, HUNK CYP1A1 2318/4885CYP1B1 1102/4885CYP1A2 1678/4885
US-20150182528-A1 THIOCHROMENE DERIVATIVES AS HIF HYDROXYLASE INHIBITORS HIF1AN, HIF1A, EGLN2 CYP1A1 220/4885CYP1B1 594/4885CYP1A2 406/4885

“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.