SCHEMBL613846

SCHEMBL613846

O=Cc1cc(Cl)ccc1OC(F)F

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 4/20 0.47
TDP1 Q9NUW8 1/20 0.46
KMT2A Q03164 4/20 0.40
MAPT P10636 3/20 0.40
MEN1 O00255 3/20 0.40
HPGD P15428 3/20 0.39
ALDH1A1 P00352 2/20 0.39
POLB P06746 2/20 0.39
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
DRD1 P21728 2/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HTT P42858 1/20 0.37
PDE4A P27815 1/20 0.37
TTR P02766 1/20 0.36

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
SCHEMBL30480709 1.00 ERN1 (0.47) ERN1TDP1KMT2AMAPTMEN1
SCHEMBL30304192 0.86 TDP1 (0.50) ERN1TDP1KMT2AMAPTMEN1
SCHEMBL16797802 0.86 TDP1 (0.50) ERN1TDP1KMT2AMAPTMEN1
SCHEMBL30933788 0.82 ERN1 (0.47) ERN1TDP1MAPTHPGDALDH1A1
SCHEMBL4209586 0.82 ERN1 (0.47) ERN1TDP1MAPTHPGDALDH1A1
SCHEMBL16954082 0.82 TSHR (0.41) ERN1KMT2AMAPTMEN1HPGD
SCHEMBL16957482 0.82 LMNA (0.38) KMT2AMAPTMEN1HPGDALDH1A1
SCHEMBL31006009 0.80 DRD1 (0.42) ERN1KMT2AMAPTALDH1A1POLB
SCHEMBL16793397 0.80 DRD1 (0.42) ERN1KMT2AMAPTALDH1A1POLB
SCHEMBL14785211 0.79 ERN1 (0.44) ERN1TDP1HPGDALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3558298-B1 ANTIDIABETIC SPIROCHROMAN COMPOUNDS MERCK SHARP & DOHME LLC (US) 2026-03-11 EP disclosed
US-12404274-B2 Macrocycles as factor xia inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2025-09-02 US disclosed
EP-4605409-A2 CYCLIN INHIBITORS Circle Pharma, Inc. (US) 2025-08-27 EP disclosed
US-20240218021-A1 CYCLIN INHIBITORS CIRCLE PHARMA, INC. 2024-07-04 US disclosed
WO-2024086814-A2 CYCLIN INHIBITORS CIRCLE PHARMA, INC. (US) 2024-04-25 WO disclosed
CN-107973809-B Macrocyclic compounds as factor XIA inhibitors 百时美施贵宝公司 2023-06-30 CN disclosed
US-20230058729-A1 MACROCYCLES AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2023-02-23 US disclosed
US-11136327-B2 Macrocycles as factor XIA inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-10-05 US disclosed
CN-107690434-B Fused tricyclic imidazopyrazine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2021-07-30 CN disclosed
US-10968232-B2 Antidiabetic spirochroman compounds MERCK SHARP & DOHME CORP. (US) 2021-04-06 US disclosed
WO-2013056060-A1 SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUNDS AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-18 WO disclosed
WO-2013022814-A1 CYCLIC P1 LINKERS AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2013-02-14 WO disclosed
EP-2534152-A1 MACROCYCLES AS FACTOR XIA INHIBITORS Bristol-Myers Squibb Company (US) 2012-12-19 EP disclosed
EP-2534154-A1 MACROCYCLES AS FACTOR XIA INHIBITORS Bristol-Myers Squibb Company (US) 2012-12-19 EP disclosed
CN-102834397-A Macrocyclic compounds as factor XIA inhibitors BRISTOL MYERS SQUIBB CO 2012-12-19 CN disclosed
US-20120309960-A1 MACROCYCLES AS FACTOR XIA INHIBITORS BRISTOL-MEYERS SQUIBB COMPANY 2012-12-06 US disclosed
CN-102753555-A Macrocycles as factor XIA inhibitors BRISTOL MYERS SQUIBB CO 2012-10-24 CN disclosed
US-20120041190-A1 MACROCYCLES AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-02-16 US disclosed
WO-2011100402-A1 MACROCYCLES AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2011-08-18 WO disclosed
WO-2011100401-A1 MACROCYCLES AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2011-08-18 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 (7 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-20120041190-A1 MACROCYCLES AS FACTOR XIA INHIBITORS TFPI, TFPI2, F11 ERN1 1605/4885TDP1 2393/4885KMT2A 1111/4885
US-12404274-B2 Macrocycles as factor xia inhibitors TFPI, TFPI2, F11 ERN1 1605/4885TDP1 2393/4885KMT2A 1111/4885
US-10968232-B2 Antidiabetic spirochroman compounds GPR119, GPR52, GPR55 ERN1 2413/4885TDP1 4282/4885KMT2A 4016/4885
US-11136327-B2 Macrocycles as factor XIA inhibitors TFPI, TFPI2, F11 ERN1 1605/4885TDP1 2393/4885KMT2A 1111/4885
US-20240218021-A1 CYCLIN INHIBITORS CCNI, CCNC, CDK2 ERN1 874/4885TDP1 1596/4885KMT2A 1479/4885
US-20230058729-A1 MACROCYCLES AS FACTOR XIA INHIBITORS TFPI, TFPI2, F11 ERN1 1605/4885TDP1 2393/4885KMT2A 1111/4885
US-20120309960-A1 MACROCYCLES AS FACTOR XIA INHIBITORS TFPI, TFPI2, F11 ERN1 1605/4885TDP1 2393/4885KMT2A 1111/4885

“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.