SCHEMBL18996867

SCHEMBL18996867

OB(O)c1cnn(Cc2ccc(F)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.58
▸ MAPT P10636 4/20 0.58
▸ CREBBP Q92793 1/20 0.47
▸ ALDH1A1 P00352 5/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ HTT P42858 3/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ TCF4 P15884 1/20 0.41
▸ CTNNB1 P35222 1/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ RAB9A P51151 3/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ KDM4E B2RXH2 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ SCD5 Q86SK9 1/20 0.39
▸ MITF O75030 1/20 0.38

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
SCHEMBL578237 0.83 L3MBTL1 (0.57) CREBBPALDH1A1SMN1; SMN2HSD17B10L3MBTL1
SCHEMBL18996866 0.83 SCD (0.49) L3MBTL1SCD5
SCHEMBL12266128 0.82 CYP3A4 (0.43) LMNAMAPTALDH1A1MAPK1HSD17B10
SCHEMBL16846806 0.79 KLKB1 (0.43) LMNAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL16095293 0.78 LMNA (0.63) LMNAMAPTCREBBPALDH1A1SMN1; SMN2
SCHEMBL18996861 0.78 ADORA2B (0.44) LMNAMAPTALDH1A1L3MBTL1POLB
SCHEMBL3085851 0.77 LMNA (0.61) LMNAMAPTCREBBPALDH1A1SMN1; SMN2
SCHEMBL18996865 0.76 JAK2 (0.36) LMNAMAPTSCD5
SCHEMBL29736946 0.76 KDM4E (0.47) LMNAALDH1A1SMN1; SMN2HTTHSD17B10
SCHEMBL16713465 0.75 L3MBTL1 (0.51) ALDH1A1SMN1; SMN2L3MBTL1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210009567-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2021-01-14 — — US disclosed
US-20200055843-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2020-02-20 — — US disclosed
US-20190092759-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2019-03-28 — — US disclosed
US-20180222893-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2018-08-09 — — US disclosed
US-20180222893-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2018-08-09 — — US disclosed
US-9975882-B2 Heteroaromatic compounds as BTK inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-05-22 — — US disclosed
US-9975882-B2 Heteroaromatic compounds as BTK inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-05-22 — — US disclosed
US-20180030037-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2018-02-01 — — US disclosed
US-20180030037-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2018-02-01 — — US disclosed
US-9815822-B2 — — 2017-11-14 — — US disclosed
US-9815822-B2 — — 2017-11-14 — — US disclosed
US-20170174663-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-06-22 — — US disclosed
US-20170174663-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-06-22 — — 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 (6 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-20180222893-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK LMNA 3779/4885MAPT 4377/4885CREBBP 1477/4885
US-20200055843-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK LMNA 3779/4885MAPT 4377/4885CREBBP 1477/4885
US-20170174663-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK LMNA 3779/4885MAPT 4377/4885CREBBP 1477/4885
US-20180030037-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK LMNA 3779/4885MAPT 4377/4885CREBBP 1477/4885
US-20190092759-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK LMNA 3779/4885MAPT 4377/4885CREBBP 1477/4885
US-20210009567-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK LMNA 3779/4885MAPT 4377/4885CREBBP 1477/4885

“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.

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